1,2-双(3-甲基苯氧基)乙烷 | 54914-85-1

• 物质功能分类: 催化剂及助剂
• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 中文名称: 1,2-双(3-甲基苯氧基)乙烷
• 中文别名: 1,2-二间甲苯氧基乙烷；1,2-二-(3-甲基苯氧基)乙烷
• 英文名称: 1,2-di(3-methylphenoxy)ethane
• 英文别名: 1,2-bis(3-methylphenoxy)ethane；1,2-di(m-methylphenoxy)ethane；1,2-bis-m-tolyloxy-ethane；1,2-Bis-m-tolyloxy-aethan；α.β-Di-m-kresoxy-aethan；Aethylenglykol-di-m-tolylaether；1-methyl-3-[2-(3-methylphenoxy)ethoxy]benzene
• CAS: 54914-85-1
• 化学式: C₁₆H₁₈O₂
• 分子量: 242.318
• InChiKey: OAGNKYSIOSDNIG-UHFFFAOYSA-N

物化性质

• 熔点：
  96.0 to 100.0 °C
• 沸点：
  381.8±30.0 °C(Predicted)
• 密度：
  1.049±0.06 g/cm3(Predicted)
• 溶解度：
  可溶于氯仿（轻微）、甲醇（非常轻微）
• LogP：
  3.94 at 21℃
• 表面张力：
  72.6mN/m at 400μg/L and 20℃
• 物理描述：
  DryPowder, WetSolid

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  18.5
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 危险等级：
  9
• 安全说明：
  S60,S61
• 危险类别码：
  R50/53
• 海关编码：
  2909309090
• 储存条件：
  室温且干燥环境下使用。

SDS

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Section 1. IDENTIFICATION OF THE SUBSTANCE/MIXTURE
Product identifiers
Product name : 1,2-Bis(3-methylphenoxy)ethane
CAS-No. : 54914-85-1
Relevant identified uses of the substance or mixture and uses advised against
Identified uses : Laboratory chemicals, Manufacture of substances

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Section 2. HAZARDS IDENTIFICATION
Classification of the substance or mixture
Classification according to Regulation (EC) No 1272/2008 [EU-GHS/CLP]
Acute aquatic toxicity (Category 1)
Chronic aquatic toxicity (Category 1)
Classification according to EU Directives 67/548/EEC or 1999/45/EC
Very toxic to aquatic organisms, may cause long-term adverse effects in the aquatic environment.
Label elements
Labelling according Regulation (EC) No 1272/2008 [CLP]
Pictogram
Signal word Warning
Hazard statement(s)
H410 Very toxic to aquatic life with long lasting effects.
Precautionary statement(s)
P273 Avoid release to the environment.
P501 Dispose of contents/ container to an approved waste disposal plant.
Supplemental Hazard none
Statements
According to European Directive 67/548/EEC as amended.
Hazard symbol(s)
R-phrase(s)
R50/53 Very toxic to aquatic organisms, may cause long-term adverse effects in
the aquatic environment.
S-phrase(s)
S60 This material and its container must be disposed of as hazardous waste.
S61 Avoid release to the environment. Refer to special instructions/ Safety
data sheets.
Other hazards - none

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Section 3. COMPOSITION/INFORMATION ON INGREDIENTS
Substances
Formula : C16H18O2
Molecular Weight : 242,31 g/mol
Component Concentration
1,2-Bis(3-methylphenoxy)ethane
CAS-No. 54914-85-1 -
EC-No. 402-730-9
Index-No. 604-058-00-3

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Section 4. FIRST AID MEASURES
Description of first aid measures
General advice
Consult a physician. Show this safety data sheet to the doctor in attendance.
If inhaled
If breathed in, move person into fresh air. If not breathing, give artificial respiration. Consult a physician.
In case of skin contact
Wash off with soap and plenty of water. Consult a physician.
In case of eye contact
Flush eyes with water as a precaution.
If swallowed
Never give anything by mouth to an unconscious person. Rinse mouth with water. Consult a physician.
Most important symptoms and effects, both acute and delayed
To the best of our knowledge, the chemical, physical, and toxicological properties have not been
thoroughly investigated.
Indication of any immediate medical attention and special treatment needed
no data available

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Section 5. FIREFIGHTING MEASURES
Extinguishing media
Suitable extinguishing media
Use water spray, alcohol-resistant foam, dry chemical or carbon dioxide.
Special hazards arising from the substance or mixture
Carbon oxides
Advice for firefighters
Wear self contained breathing apparatus for fire fighting if necessary.
Further information
no data available

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Section 6. ACCIDENTAL RELEASE MEASURES
Personal precautions, protective equipment and emergency procedures
Use personal protective equipment. Avoid breathing vapors, mist or gas. Ensure adequate ventilation.
Evacuate personnel to safe areas.
Environmental precautions
Prevent further leakage or spillage if safe to do so. Do not let product enter drains. Discharge into the
environment must be avoided.
Methods and materials for containment and cleaning up
Soak up with inert absorbent material and dispose of as hazardous waste. Keep in suitable, closed
containers for disposal.
Reference to other sections
For disposal see section 13.

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Section 7. HANDLING AND STORAGE
Precautions for safe handling
no data available
Conditions for safe storage, including any incompatibilities
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Containers which are
opened must be carefully resealed and kept upright to prevent leakage.
Specific end uses
no data available

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Section 8. EXPOSURE CONTROLS/PERSONAL PROTECTION
Control parameters
Components with workplace control parameters
Exposure controls
Appropriate engineering controls
Handle in accordance with good industrial hygiene and safety practice. Wash hands before breaks and
at the end of workday.
Personal protective equipment
Eye/face protection
Use equipment for eye protection tested and approved under appropriate government standards
such as NIOSH (US) or EN 166(EU).
Skin protection
Handle with gloves. Gloves must be inspected prior to use. Use proper glove removal technique
(without touching glove's outer surface) to avoid skin contact with this product. Dispose of
contaminated gloves after use in accordance with applicable laws and good laboratory practices.
Wash and dry hands.
The selected protective gloves have to satisfy the specifications of EU Directive 89/686/EEC and
the standard EN 374 derived from it.
Body Protection
impervious clothing, The type of protective equipment must be selected according to the
concentration and amount of the dangerous substance at the specific workplace.
Respiratory protection
Where risk assessment shows air-purifying respirators are appropriate use a full-face respirator
with multi-purpose combination (US) or type ABEK (EN 14387) respirator cartridges as a backup
to engineering controls. If the respirator is the sole means of protection, use a full-face supplied air
respirator. Use respirators and components tested and approved under appropriate government
standards such as NIOSH (US) or CEN (EU).

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Section 9. PHYSICAL AND CHEMICAL PROPERTIES
Information on basic physical and chemical properties
a) Appearance Form: liquid
b) Odour no data available
c) Odour Threshold no data available
d) pH no data available
e) Melting point/freezing no data available
point
f) Initial boiling point and no data available
boiling range
g) Flash point no data available
h) Evaporation rate no data available
i) Flammability (solid, gas) no data available
j) Upper/lower no data available
flammability or
explosive limits
k) Vapour pressure no data available
l) Vapour density no data available
m) Relative density no data available
n) Water solubility no data available
o) Partition coefficient: n- log Pow: 4,358
octanol/water
p) Autoignition no data available
temperature
q) Decomposition no data available
temperature
r) Viscosity no data available
s) Explosive properties no data available
t) Oxidizing properties no data available
Other safety information
no data available

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Section 10. STABILITY AND REACTIVITY
Reactivity
no data available
Chemical stability
no data available
Possibility of hazardous reactions
no data available
Conditions to avoid
no data available
Incompatible materials
Strong oxidizing agents
Hazardous decomposition products
Other decomposition products - no data available

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Section 11. TOXICOLOGICAL INFORMATION
Information on toxicological effects
Acute toxicity
no data available
Skin corrosion/irritation
no data available
Serious eye damage/eye irritation
no data available
Respiratory or skin sensitization
no data available
Germ cell mutagenicity
no data available
Carcinogenicity
IARC: No component of this product present at levels greater than or equal to 0.1% is identified as
probable, possible or confirmed human carcinogen by IARC.
Reproductive toxicity
no data available
Specific target organ toxicity - single exposure
no data available
Specific target organ toxicity - repeated exposure
no data available
Aspiration hazard
no data available
Potential health effects
Inhalation May be harmful if inhaled. May cause respiratory tract irritation.
Ingestion May be harmful if swallowed.
Skin May be harmful if absorbed through skin. May cause skin irritation.
Eyes May cause eye irritation.
Signs and Symptoms of Exposure
To the best of our knowledge, the chemical, physical, and toxicological properties have not been
thoroughly investigated.
Additional Information
RTECS: Not available

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Section 12. ECOLOGICAL INFORMATION
Toxicity
no data available
Persistence and degradability
no data available
Bioaccumulative potential
no data available
Mobility in soil
no data available
Results of PBT and vPvB assessment
no data available
Other adverse effects
Very toxic to aquatic life.

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Section 13. DISPOSAL CONSIDERATIONS
Waste treatment methods
Product
Offer surplus and non-recyclable solutions to a licensed disposal company.
Contaminated packaging
Dispose of as unused product.

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Section 14. TRANSPORT INFORMATION
UN number
ADR/RID: 3082 IMDG: 3082 IATA: 3082
UN proper shipping name
ADR/RID: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S. (1,2-Bis(3-
methylphenoxy)ethane)
IMDG: ENVIRONMENTALLY HAZARDOUS SUBSTANCE, LIQUID, N.O.S. (1,2-Bis(3-
methylphenoxy)ethane)
IATA: Environmentally hazardous substance, liquid, n.o.s. (1,2-Bis(3-methylphenoxy)ethane)
Transport hazard class(es)
ADR/RID: 9 IMDG: 9 IATA: 9
Packaging group
ADR/RID: III IMDG: III IATA: III
Environmental hazards
ADR/RID: yes IMDG Marine pollutant: yes IATA: yes
Special precautions for user
Further information
EHS-Mark required (ADR 2.2.9.1.10, IMDG code 2.10.3) for single packagings and combination
packagings containing inner packagings with Dangerous Goods > 5L for liquids or > 5kg for solids.

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Section 15. REGULATORY INFORMATION
This safety datasheet complies with the requirements of Regulation (EC) No. 1907/2006.
Safety, health and environmental regulations/legislation specific for the substance or mixture
no data available
Chemical Safety Assessment
no data available

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Section 16. OTHER INFORMATION
Further information
Copyright 2012 Co. LLC. License granted to make unlimited paper copies for internal use
only.
The above information is believed to be correct but does not purport to be all inclusive and shall be
used only as a guide. The information in this document is based on the present state of our knowledge
and is applicable to the product with regard to appropriate safety precautions. It does not represent any
guarantee of the properties of the product. Corporation and its Affiliates shall not be held
liable for any damage resulting from handling or from contact with the above product. See
and/or the reverse side of invoice or packing slip for additional terms and conditions of sale.

反应信息

• 作为反应物：
  描述：

  1,2-双(3-甲基苯氧基)乙烷 在 四氯化碳 、 N-溴代丁二酰亚胺(NBS) 、 过氧化苯甲酰 作用下， 生成 1,2-bis-(4-bromo-3-methyl-phenoxy)-ethane
  参考文献：
  名称：

  Kyi, Huaxue Xuebao/Acta Chimica Sinica, 1959, vol. 25, p. 100,102

  摘要：

  DOI：
• 作为产物：
  描述：

  吡啶 、 3-甲苯氧基乙酸 在 氢氧化钾 作用下， 生成 1,2-双(3-甲基苯氧基)乙烷
  参考文献：
  名称：

  科尔贝“血清胆碱酯酶elektrochemische Synthesen MIT aromatischenSäuren

  摘要：

  DOI：

  10.1002/hlca.19420250414
• 作为试剂：
  描述：

  对甲酚 、 间甲酚 、 、 、 、 1,2-二溴乙烷 、 1,2-二氯乙烷 以 1,2-双(3-甲基苯氧基)乙烷 为溶剂， 以In this manner, 1-(3-methylphenoxy)-2-(4-methylphenoxy)ethane and/or 1,2-bis(4-methylphenoxy)ethane are/is formed in 1,2-bis(3-methylphenoxy)ethane that的产率得到1-(3-methylphenoxy)-2-(4-methylphenoxy)ethane
  参考文献：
  名称：

  1,2-bis(3-methylphenoxy)ethane composition and thermal recording media made by using the same

  摘要：

  在包括基本显色染料、显影剂和敏化剂的热记录介质中，一种用于热记录介质的组合物，其组成物含有50 ppm至5.0质量％的1-(3-甲基苯氧基)-2-(4-甲基苯氧基)乙烷和/或1,2-双(4-甲基苯氧基)乙烷在1,2-双(3-甲基苯氧基)乙烷中用作所述敏化剂，由此显着改善了1,2-双(3-甲基苯氧基)乙烷化合物在上述敏化剂的制备中的磨研性能，并提供了一种热记录介质，而不会损害热色性等颜色性能。

  公开号：

  US07645396B2

文献信息

• COMPOUND COMPRISING PHENYL PYRIDINE UNITS
  申请人：Ye Qing

  公开号：US20090289547A1

  公开（公告）日：2009-11-26

  Organic compounds of formula I may be used in optoelectronic devices wherein R 1 is, independently at each occurrence, a C 1 -C 20 aliphatic radical, a C 3 -C 20 aromatic radical, or a C 3 -C 20 cycloaliphatic radical; R2 is, independently at each occurrence, a C 1 -C 20 aliphatic radical, a C 3 -C 20 aromatic radical, or a C 3 -C 20 cycloaliphatic radical; a is, independently at each occurrence, an integer ranging from 0-4; b is, independently at each occurrence, an integer ranging from 0-3; Ar 1 is a direct bond or heteroaryl, aryl, or alkyl or cycloalkyl; Ar 2 is heteroaryl, aryl, or alkyl or cycloalkyl; c is 0, 1 or 2; and n is an integer ranging from 2-4.

  化学式I的有机化合物可用于光电子器件，其中R1在每次出现时独立地是C1-C20脂肪基、C3-C20芳香基或C3-C20环脂肪基；R2在每次出现时独立地是C1-C20脂肪基、C3-C20芳香基或C3-C20环脂肪基；a在每次出现时独立地是0-4之间的整数；b在每次出现时独立地是0-3之间的整数；Ar1是直接键或杂环芳基、芳基、烷基或环烷基；Ar2是杂环芳基、芳基、烷基或环烷基；c为0、1或2；n是2-4之间的整数。
• RECORDING MATERIAL PRODUCED USING NON-PHENOL COMPOUND
  申请人：NIPPON SODA CO., LTD.

  公开号：US20150284321A1

  公开（公告）日：2015-10-08

  An object of the present invention is to provide a recording material or a recording sheet using, as a color-developing agent, a non-phenol compound that is a safe compound in no danger of corresponding to an endocrine disruptor and is good in color developing performance. The non-phenol compound used in the present invention is at least one selected from the group consisting of compounds represented by the following formulas (I) to (III).

  本发明的目的是提供一种使用非酚类化合物作为显色剂的记录材料或记录纸，该非酚类化合物是一种安全化合物，不会对应到内分泌干扰物，并且在显色性能方面表现良好。本发明中使用的非酚类化合物至少选自以下化合物所代表的化合物组，其化学式为(I)至(III)。
• N,N'-DIARYLUREA DERIVATIVE, MANUFACTURING METHOD THEREOF, AND THERMOSENSITIVE RECORDING MATERIAL USING SAME
  申请人：SANKO CO., LTD.

  公开号：US20210340099A1

  公开（公告）日：2021-11-04

  The present invention relates to an N,N′-diurea derivative represented by the following general formula (1) and a method for producing the same. In addition, the present invention relates to a thermosensitive recording material in which a thermosensitive recording layer including a basic dye which is colorless or lightly colored at room temperature and a developer capable of developing color upon contact with the basic dye by heating is provided on a base sheet, wherein the developer is the N,N′-diurea derivative represented by the following general formula (1): (wherein R2 is an alkyl group, an aralkyl group, or an aryl group; and A 1 is a hydrogen atom or an alkyl group).

  本发明涉及一种由以下一般式（1）表示的N,N′-二脲衍生物以及其制备方法。此外，本发明涉及一种热敏记录材料，其中在基底纸上提供了一个热敏记录层，该热敏记录层包括在室温下无色或轻染色的碱性染料和一种与碱性染料接触加热后能够显色的显色剂，其中显色剂为以下一般式（1）表示的N,N′-二脲衍生物：（其中R2为烷基、芳基烷基或芳基；A1为氢原子或烷基）。
• Production of 2-hydroxynaphthalene-3-carboxylic acid
  申请人：BASF Aktiengesellschaft

  公开号：US04032568A1

  公开（公告）日：1977-06-28

  2-HYDROXYNAPHTHALENE-3-CARBOXYLIC ACID IS PRODUCED BY HEATING A MIXTURE OF POTASSIUM .beta.-NAPHTHOLATE AND SODIUM .beta.-NAPHTHOLATE TO A TEMPERATURE OF AT LEAST 180.degree. C, reacting it with carbon dioxide and treating the salt formed with an acid. The product is a dye intermediate, a coupling component of surface coating dyes and chrome dyes, and a developer for diazo dyes.

  2-羟基萘-3-羧酸是通过加热钾β-萘酚盐和钠β-萘酚盐的混合物至至少180摄氏度，与二氧化碳反应，并用酸处理形成的盐来生产的。该产品是一种染料中间体，是表面涂料染料和铬染料的偶联组分，也是重氮染料的显影剂。
• Thermosensitive recording material and color developer compound therefor
  申请人：——

  公开号：US20040071187A1

  公开（公告）日：2004-04-15

  A thermosensitive recording material has a support and a thermosensitive coloring layer formed thereon containing a leuco dye and a color developer capable of inducing color formation in the leuco dye upon application of heat thereto, with the color developer including at least one compound (A) having in a molecule thereof at least two aromatic ring moieties with specific structures, selected from the group consisting of an aromatic ring moiety having at least one carboxyl group and electron-attracting functional group, an aromatic ring moiety having at least one carboxyl group and electron-donating functional group, and an aromatic ring moiety having at least one carboxyl group, free of the electron-attracting and electron-donating functional groups. An aromatic carboxylic acid compound serving as the above-mentioned compound (A) and the producing method thereof are also disclosed.

  一种热敏感记录材料具有支撑体和在其上形成的热敏感着色层，其中该着色层含有一种白色染料和一种色素显色剂，能够在施加热量时诱导白色染料发生显色反应，其中色素显色剂包括至少一种化合物（A），其分子中至少含有两个具有特定结构的芳香环基团，所述芳香环基团选自具有至少一个羧基和电子吸引基团的芳香环基团、具有至少一个羧基和电子给予基团的芳香环基团以及不含电子吸引和电子给予功能基团的芳香环基团。还公开了作为上述化合物（A）的芳香羧酸化合物及其生产方法。

表征谱图