N1-苯基环己-1-胺盐酸盐 | 64316-73-0

• 分子结构分类: 有机化合物 - 有机氮化合物
• 中文名称: N1-苯基环己-1-胺盐酸盐
• 中文别名: N1-苯基-1-环己胺盐酸盐
• 英文名称: N-cyclohexylaniline hydrochloride
• 英文别名: N-cyclohexylaniline;hydrochloride
• CAS: 64316-73-0
• 化学式: C₁₂H₁₇N*ClH
• 分子量: 211.735
• InChiKey: DVGLBMLXBJFWSX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.78
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  16.6
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 危险品标志：
  Xi
• 海关编码：
  2921420090

SDS

Name:	N1-Phenylcyclohexan-1-amine hydrochloride tech Material Safety Data Sheet
Synonym:	N-Cyclohexylaniline hydrochlorid
CAS:	64316-73-0

Section 1 - Chemical Product MSDS Name:N1-Phenylcyclohexan-1-amine hydrochloride tech Material Safety Data Sheet
Synonym:N-Cyclohexylaniline hydrochlorid

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Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
64316-73-0	N1-Phenylcyclohexan-1-amine hydrochlor		unlisted

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

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Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May be harmful if inhaled.
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:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately.
Notes to Physician:
Treat symptomatically and supportively.

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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.

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Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal 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:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 64316-73-0: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
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: Solid
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: Not available.
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C12H18ClN
Molecular Weight: 212

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Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Acids, bases, strong oxidizing agents.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide, ammonia.
Hazardous Polymerization: Has not been reported

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Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 64316-73-0 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
N1-Phenylcyclohexan-1-amine hydrochloride - 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
No information available.
IMO
No information available.
RID/ADR
No information available.

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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# 64316-73-0: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 64316-73-0 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 64316-73-0 is not listed on the TSCA inventory.
It is for research and development use only.

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SECTION 16 - ADDITIONAL INFORMATION
N/A

反应信息

• 作为反应物：
  描述：

  N1-苯基环己-1-胺盐酸盐 在 氯仿 、 溴 、 xylene 作用下， 生成 2-amino-3-cyclohexyl-benzothiazolium; bromide
  参考文献：
  名称：

  Uschenko, Sb. Statei Obshch. Khim., 1953, p. 516,519

  摘要：

  DOI：
• 作为产物：
  描述：

  环己酮 、 苯胺 在 palladium on activated charcoal ammonium formate 作用下， 以 甲醇 、 水 为溶剂， 以70%的产率得到N1-苯基环己-1-胺盐酸盐
  参考文献：
  名称：

  A modified palladium catalysed reductive amination procedure

  摘要：

  New, extended applications of a modified palladium catalysed reductive amination procedure are described; a mechanistic hypothesis alternative to the common imine pathway is proposed. This versatile method advances the usual reductive amination processes in terms of yield and shows high stereoselectivity whether applied to constrained carbonyl compounds. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4020(02)00530-6

文献信息

• Particularly substituted thiazolesulfenamides
  申请人：UOP Inc.

  公开号：US04041043A1

  公开（公告）日：1977-08-09

  Novel compounds comprising N-phenyl-N-R-benzothiazole-2-sulfenamides in which R is an akyl radical or cycloalkyl radical are useful as rubber additives.

  含有N-苯基-N-R-苯并噻唑-2-磺酰胺的新化合物，其中R是烷基或环烷基基团，可用作橡胶添加剂。
• [EN] CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS<br/>[FR] DERIVES DE CYCLOHEXYLE ET LEUR UTILISATION COMME AGENTS THERAPEUTIQUES
  申请人：MERCK SHARP & DOHME

  公开号：WO2001087838A1

  公开（公告）日：2001-11-22

  The present invention relates compounds of formula (I), wherein ring A is a phenyl or pyridyl ring; X represents a linker selected from the group consisting of formulae: (a), (b), (c), (d), and (e); and R?1, R2, R3, R4, R5, R6, R7, R13, R14, R15, R16, R17, R21a and R21b¿ are as defined herein. The compounds are of particular use in the treatment or prevention of depression, anxiety, pain, inflammation, migraine, emesis or postherpetic neuralgia.

  本发明涉及公式（I）的化合物，其中环A是苯环或吡啶环；X代表从公式（a）、（b）、（c）、（d）和（e）组成的链连接物；R?1、R2、R3、R4、R5、R6、R7、R13、R14、R15、R16、R17、R21a和R21b¿如本文所定义。该化合物特别适用于治疗或预防抑郁症、焦虑症、疼痛、炎症、偏头痛、呕吐或带状疱疹后神经痛。
• Busch; Gebelein, Journal fur praktische Chemie (Leipzig 1954), 1927, vol. <2>115, p. 111
  作者：Busch、Gebelein

  DOI：——

  日期：——
• CYCLOHEXANE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS
  申请人：MERCK SHARP & DOHME LTD.

  公开号：EP1286967A1

  公开（公告）日：2003-03-05
• US4041043A
  申请人：——

  公开号：US4041043A

  公开（公告）日：1977-08-09