[1,1'-联环己基]-1-醇 | 2903-12-0

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: [1,1'-联环己基]-1-醇
• 英文名称: 1-cyclohexylcyclohexanol
• 英文别名: 1-Cyclohexyl-cyclohexanol-(1)；(1,1'-Bicyclohexyl)-1-ol；1-cyclohexylcyclohexan-1-ol
• CAS: 2903-12-0
• 化学式: C₁₂H₂₂O
• 分子量: 182.306
• InChiKey: PVSNMDAHWMHSBD-UHFFFAOYSA-N

物化性质

• 熔点：
  51 °C
• 沸点：
  148 °C(Press: 20 Torr)
• 密度：
  0.9817 g/cm3

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  13
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2906199090

SDS

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SECTION 1: Identification of the substance/mixture and of the company/undertaking
Product identifiers
Product name : [1,1'-Bicyclohexyl]-1-ol
REACH No. : A registration number is not available for this substance as the substance
or its uses are exempted from registration, the annual tonnage does not
require a registration or the registration is envisaged for a later
registration deadline.
CAS-No. : 2903-12-0
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
Acute toxicity, Oral (Category 4), H302
For the full text of the H-Statements mentioned in this Section, see Section 16.
Classification according to EU Directives 67/548/EEC or 1999/45/EC
Xn Harmful R22
For the full text of the R-phrases mentioned in this Section, see Section 16.
Label elements
Labelling according Regulation (EC) No 1272/2008
Pictogram
Signal word Warning
Hazard statement(s)
H302 Harmful if swallowed.
Precautionary statement(s) none
Supplemental Hazard none
Statements
Other hazards - none

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SECTION 3: Composition/information on ingredients
Substances
Synonyms : 1-Cyclohexylcyclohexanol
Formula : C12H22O
Molecular Weight : 182,31 g/mol
CAS-No. : 2903-12-0
EC-No. : 220-799-1
Hazardous ingredients according to Regulation (EC) No 1272/2008
Component Classification Concentration
[1,1'-Biciclohexil]-1-ol
Acute Tox. 4; H302 -
Hazardous ingredients according to Directive 1999/45/EC
Component Classification Concentration
[1,1'-Biciclohexil]-1-ol
Xn, R22 -
For the full text of the H-Statements and R-Phrases mentioned in this Section, see Section 16

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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
The most important known symptoms and effects are described in the labelling (see section 2.2) and/or in
section 11
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 dust formation. Avoid breathing vapours, mist or gas. Ensure
adequate ventilation. Avoid breathing dust.
For personal protection see section 8.
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
Pick up and arrange disposal without creating dust. Sweep up and shovel. 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
Avoid contact with skin and eyes. Avoid formation of dust and aerosols.
Provide appropriate exhaust ventilation at places where dust is formed.
For precautions see section 2.2.
Conditions for safe storage, including any incompatibilities
Store in cool place. Keep container tightly closed in a dry and well-ventilated place.
Specific end use(s)
A part from the uses mentioned in section 1.2 no other specific uses are stipulated

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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
Safety glasses with side-shields conforming to EN166 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
Complete suit protecting against chemicals, The type of protective equipment must be selected
according to the concentration and amount of the dangerous substance at the specific workplace.
Respiratory protection
For nuisance exposures use type P95 (US) or type P1 (EU EN 143) particle respirator.For higher
level protection use type OV/AG/P99 (US) or type ABEK-P2 (EU EN 143) respirator cartridges.
Use respirators and components tested and approved under appropriate government standards
such as NIOSH (US) or CEN (EU).
Control of environmental exposure
Prevent further leakage or spillage if safe to do so. Do not let product enter drains. Discharge into
the environment must be avoided.

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SECTION 9: Physical and chemical properties
Information on basic physical and chemical properties
a) Appearance Form: solid
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) Evapouration 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: 2,762
octanol/water
p) Auto-ignition 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
Stable under recommended storage conditions.
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
In the event of fire: see section 5

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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 sensitisation
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
Additional Information
RTECS: Not available
To the best of our knowledge, the chemical, physical, and toxicological properties have not been
thoroughly investigated.

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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
PBT/vPvB assessment not available as chemical safety assessment not required/not conducted
Other adverse effects
Harmful to aquatic life.
no data available

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SECTION 13: Disposal considerations
Waste treatment methods
Product
Offer surplus and non-recyclable solutions to a licensed disposal company. Dissolve or mix the material
with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber.
Contaminated packaging
Dispose of as unused product.

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SECTION 14: Transport information
UN number
ADR/RID: - IMDG: - IATA: -
UN proper shipping name
ADR/RID: Not dangerous goods
IMDG: Not dangerous goods
IATA: Not dangerous goods
Transport hazard class(es)
ADR/RID: - IMDG: - IATA: -
Packaging group
ADR/RID: - IMDG: - IATA: -
Environmental hazards
ADR/RID: no IMDG Marine pollutant: no IATA: no
Special precautions for user
no data available

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SECTION 15 - REGULATORY INFORMATION
N/A

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  [1,1'-联环己基]-1-醇 在 氢溴酸 作用下， 生成 1-bromo-bicyclohexyl
  参考文献：
  名称：

  Criegee; Vogel; Hoeger, Chemische Berichte, 1952, vol. 85, p. 144,145

  摘要：

  DOI：
• 作为产物：
  描述：

  1-(Cyclohex-1-enyl)cyclohex-1-yl Hydroperoxide 在 甲醇 、 乙醚 、 溶剂黄146 、 三苯基膦 、 铂 作用下， 生成 [1,1'-联环己基]-1-醇
  参考文献：
  名称：

  Schenck; Schulte-Elte, Justus Liebigs Annalen der Chemie, 1958, vol. 618, p. 185,191

  摘要：

  DOI：

文献信息

• Triphosgene and DMAP as Mild Reagents for Chemoselective Dehydration of Tertiary Alcohols
  作者：Moshood O. Ganiu、Alexander H. Cleveland、Jarrod L. Paul、Rendy Kartika

  DOI：10.1021/acs.orglett.9b01959

  日期：2019.7.19

  The utility of triphosgene and DMAP as mild reagents for chemoselective dehydration of tertiary alcohols is reported. Performed in dichloromethane at room temperature, this reaction is readily tolerated by a broad scope of substrates, yielding alkenes preferentially with the (E)-geometry. While formation of the Hofmann products is generally favored, a dramatic change in alkene selectivity toward the

  据报道，三光气和DMAP作为温和试剂用于叔醇的化学选择性脱水。该反应在室温下在二氯甲烷中进行，很容易被宽范围的底物所耐受，优先以（E）-几何结构产生烯烃。尽管通常优选霍夫曼产物的形成，但是当反应在二氯乙烷中在回流下进行时，观察到烯烃对Zaitzev产物的选择性的急剧变化。
• ACID-LABILE ESTER MONOMER HAVING SPIROCYCLIC STRUCTURE, POLYMER, RESIST COMPOSITION, AND PATTERNING PROCESS
  申请人：Kinsho Takeshi

  公开号：US20100304295A1

  公开（公告）日：2010-12-02

  An acid-labile ester monomer of spirocyclic structure has formula (1) wherein Z is a monovalent group having a polymerizable double bond, X is a divalent group which forms a cyclopentane, cyclohexane or norbornane ring, R 2 is H or monovalent hydrocarbon, R 3 and R 4 are H or monovalent hydrocarbon, or R 3 and R 4 , taken together, stand for a divalent group which forms a cyclopentane or cyclohexane ring, and n is 1 or 2. A polymer obtained from the acid-labile ester monomer has so high reactivity in acid-catalyzed elimination reaction that the polymer may be used to formulate a resist composition having high resolution.

  一种酸敏感酯单体具有螺环结构，其化学式如下（1），其中Z是具有可聚合双键的一价基团，X是形成环戊烷、环己烷或诺邦烷环的二价基团，R2是H或一价碳氢基团，R3和R4是H或一价碳氢基团，或者R3和R4一起表示形成环戊烷或环己烷环的二价基团，n为1或2。从酸敏感酯单体获得的聚合物在酸催化消除反应中具有很高的反应性，因此可以用于制备具有高分辨率的抗蚀组合物。
• Azo anions in synthesis
  作者：Jack E. Baldwin、Robert M. Adlington、Jeffery C. Bottaro、Jayant N. Kolhe、Ian M. Newington、Matthew W.D. Perry

  DOI：10.1016/s0040-4020(01)87648-1

  日期：1986.1

  The lithium salts of trityl- and diphenyl-4-pyridylmethyl-hydrazones of both aldehydes and ketones react with electrophiles (alkyl halides, aldehydes, ketones, crotonates) at low temperature to form C-trapped azo compounds ; these Intermediates decompose homolytically with loss of nitrogen below room temperature and can be diverted in a synthetically useful way to alkanes, alkenes, alcohols or saturated

  醛和酮的三苯甲基和二苯基-4-吡啶基甲基-的锂盐在低温下与亲电子试剂（烷基卤化物，醛，酮，巴豆酸酯）反应，形成碳捕获的偶氮化合物；在室温以下时，这些中间体会同质分解并损失氮气，并且可以合成上有用的方式转移至烷烃，烯烃，醇或饱和酯。
• ルテニウム錯体及びその製造方法、触媒、並びに、酸素含有化合物の製造方法
  申请人：国立大学法人九州大学

  公开号：JP2021008467A

  公开（公告）日：2021-01-28

  【課題】特に炭素−水素結合を有する基質を酸化する触媒として有用なルテニウム錯体の提供。【解決手段】一般式（ｉ）で表されるルテニウム錯体、又はｃｉｓ型の配座異性体。一般式（ｉ）中、Ｒ１は、Ｈ、フェニル基又は置換されたフェニル基；Ｒ２は、Ｈ、フェニル基又はアルキル基；Ｌ１は、ハロゲン又は水分子；Ｌ２はトリフェニルホスフィン、ピリジン、イミダゾール又はジメチルスルホキシド；Ｘはハロゲン；ｎは１又は２を示す。【選択図】なし

  提供具有特别用途的钌配合物，作为氧化具有碳-氢键的底物的催化剂。一般式（i）表示的钌配合物，或者cis型异构体。在一般式（i）中，R1代表氢、苯基或取代苯基；R2代表氢、苯基或烷基；L1代表卤素或水分子；L2代表三苯基膦、吡啶、咪唑或二甲基亚砜；X代表卤素；n表示1或2。【选图】无。
• Azo anions in synthesis. Use of trityl- and diphenyl-4-pyridylmethyl-hydrazones for reductive C–C bond formation from aldehydes and ketones
  作者：Jack E. Baldwin、Jeffrey C. Bottaro、Jayant N. Kolhe、Robert M. Adlington

  DOI：10.1039/c39840000022

  日期：——

  The lithium salts for trityl- and diphenyl-4-pyridylmethyl-hydrazones of both aldehydes and ketones react with electrophiles (alkyl haldies, aldehydes, and ketones) at low temperature to form C-trapped azo compounds; these intermediates decompose homolytically with loss of nitrogen below room temperature and can be diverted in a synthetically useful way to alkanes, or alkenes, or alcohols.

  醛和酮的三苯甲基和二苯基-4-吡啶基甲基-的锂盐在低温下与亲电子试剂（烷基卤化物，醛和酮）反应，形成C捕获的偶氮化合物。在室温以下时，这些中间体会同质分解并损失氮气，并且可以以合成上有用的方式转移到烷烃，烯烃或醇中。