2-正癸基氨基乙硫醇 | 5891-06-5

• 物质功能分类: 化学试剂 - 有机试剂 - 硫醇/硫酚
• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: 2-正癸基氨基乙硫醇
• 英文名称: 2-Decylamino-aethanthiol
• 英文别名: 2-n-Decylaminoethanthiol；2-(Decylamino)ethanethiol
• CAS: 5891-06-5
• 化学式: C₁₂H₂₇NS
• mdl: MFCD00044703
• 分子量: 217.419
• InChiKey: WOWHRXFAFVDNAP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  14
• 可旋转键数：
  11
• 环数：
  0.0
• sp3杂化的碳原子比例：
  1.0
• 拓扑面积：
  13
• 氢给体数：
  2
• 氢受体数：
  2

SDS

Name:	2-N-decylaminoethanethiol 95% Material Safety Data Sheet
Synonym:
CAS:	5891-06-5

Section 1 - Chemical Product MSDS Name:2-N-decylaminoethanethiol 95% Material Safety Data Sheet
Synonym:

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
5891-06-5	2-n-Decylaminoethanethiol, 95%	95%	227-564-2

Hazard Symbols: None Listed.
Risk Phrases: None Listed.

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.Stench.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause allergic respiratory reaction.
Chronic:
Not available.

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Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Get medical aid if irritation develops or persists. Remove contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately. Get medical aid if cough or other symptoms appear.
Notes to Physician:

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Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam. Use agent most appropriate to extinguish fire.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container.

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Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.

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Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower.
Exposure Limits CAS# 5891-06-5: Personal Protective Equipment Eyes: Wear chemical splash goggles.
Skin:
Wear appropriate gloves to prevent skin exposure.
Clothing:
Wear a chemical apron.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.

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Section 9 - PHYSICAL AND CHEMICAL PROPERTIES

Physical State: Liquid
Color: clear, colorless
Odor: stench
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 124 - 128 deg C @ .40mm Hg
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: > 110 deg C (> 230.00 deg F)
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density: .8690g/cm3
Molecular Formula: C12H27NS
Molecular Weight: 217.41

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Not available.
Incompatibilities with Other Materials:
Acids, acid chlorides, acid anhydrides, oxidizing agents, chloroformates.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide.
Hazardous Polymerization: Has not been reported.

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 5891-06-5 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-n-Decylaminoethanethiol, 95% - Not listed by ACGIH, IARC, or NTP.

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Section 12 - ECOLOGICAL INFORMATION

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Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.

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Section 14 - TRANSPORT INFORMATION

IATA
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

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Section 15 - REGULATORY INFORMATION

European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 5891-06-5: No information available.
Canada
CAS# 5891-06-5 is listed on Canada's NDSL List.
CAS# 5891-06-5 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 5891-06-5 is listed on the TSCA inventory.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  2-正癸基氨基乙硫醇 在 水 、 氯 作用下， 以 乙酸乙酯 为溶剂， 以86%的产率得到2-(decylamino)ethanesulfonyl chloride;hydrochloride
  参考文献：
  名称：

  Champseix, A.; Chanet, J.; Etienne, A., Bulletin de la Societe Chimique de France, 1985, # 3, p. 463 - 472

  摘要：

  DOI：
• 作为产物：
  描述：

  环硫乙烷 、 1-氨基癸烷 生成 2-正癸基氨基乙硫醇
  参考文献：
  名称：

  Improved synthesis of aminoethanethiols

  摘要：

  DOI：

  10.1021/jo00953a027

文献信息

• Gmelin Handbuch der Anorganischen Chemie, Gmelin Handbook: Ag: MVol.B7, 1.20.2.2, page 16 - 19
  作者：

  DOI：——

  日期：——
• Antimicrobial activity of a series of aminoalkyl esters of benzyldithiocarbamic acids
  作者：Robert C. Tweit、Robert D. Muir、Seth Mizuba

  DOI：10.1021/jm00302a043

  日期：1969.3
• Organic Disulfides and Related Substances. XII. (2-Aminoethyldithio)benzoic Acids and Derivatives^1a,b
  作者：R. R. Crenshaw、Lamar Field

  DOI：10.1021/jo01012a040

  日期：1965.1
• 1-Alkyl-1-(2-mercaptoethyl)quanidines and the corresponding thioureas, disulfides, and thiosulfates and thiosulfates and antibacterial agents
  作者：Roger D. Westland、Eva R. Karger、Billie Green、John R. Dice

  DOI：10.1021/jm00307a018

  日期：1968.1
• Nouveaux dérivés de la pristinamycine IIB, leur préparation et les compostions pharmaceutiques qui les contiennent
  申请人：RHONE-POULENC SANTE

  公开号：EP0191662B1

  公开（公告）日：1988-06-01

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