4-Cyclohexylbenzenamine

HCID 80764
NotesReactions
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Basic information

CAS
6373-50-8
Standard SMILES
Nc1ccc(C2CCCCC2)cc1
InChIKey
JLNMBIKJQAKQBH-UHFFFAOYSA-N
Molecular formula
C12H17N
Average molar mass
175.27 g/mol
Monoisotopic mass
175.13609954

Overview

analgesic activity

Names & identifiers

Preferred name
4-Cyclohexylbenzenamine
IUPAC
4-cyclohexylaniline
English name
4-Cyclohexylaniline
Molecular formula
C12H17N
Molecular weight
175.27

Names & synonyms

4-Cyclohexylaniline6373-50-84-cyclohexylbenzenamine4-cyclohexylphenylamineZED2J2DT8RDTXSID60213154RefChem:522332DTXCID60135645228-918-9Benzenamine, 4-cyclohexyl-Aniline, p-cyclohexyl-p-Cyclohexylaniline
Show more names
BUTTPARK 92\50-684-Cyclohexylaniline,97%4-cyclohexylibenzenamineBenzenaMine,4-cyclohexyl-(p-Cyclohexylphenyl)amine
(4-Cyclohexylphenyl)amineMFCD000014544-Cyclohexyl-phenylamine4-cyclohexyl phenylamineEINECS 228-918-9BBL023570STL353499BP-21493

Database identifiers

CAS
6373-50-8
PubChem CID
80764
DTXSID
DTXSID60213154
ChEMBL
CHEMBL4780820
UNII
ZED2J2DT8R
EC Number
228-918-9
Nikkaji
J111.190F

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
26 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
1
Heavy atoms
13

Experimental & physicochemical properties

SpringerMaterials PropertiesChemical structure
LogP3.65

Physicochemical properties

Melting point
53 °C · 53 °C
Boiling point
166 °C · 166 °C
Density
1.013 · 1.013
refractive index
1.561 · 1.5610 (estimate)
Flash point
110 °C · 110°C
storage temp.
Keep in dark place,Sealed in dry,Room Temperature

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (11.4%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 44 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Hazard Classes and CategoriesAcute Tox. 4 (11.4%)

Safety data

ridadr
2811
hs_code
2921490090
risk_code
36/37/38
Signal word
Warning
Symbol(GHS)
GHS07
hazard_note
Harmful

Chemistry & industry

Applications · 1 item

Uses4-Cyclohexylaniline is used as a starting material for the preparation of 1-cyclohexyl-4-nitroso-benzene. It is used as a reactant in nucleophilic acylation to form N-(4-cyclohexylphenyl)acetamide by reacting with acetyl halides. It is also involved in the synthesis of N-(4-cyclohexylphenyl)-2-morpholino-acetamide by reaction with 2-morpholinoacetyl fluoride. Further, it reacts with 4-bromo-4-oxo-butanoic acid to get 4-[(4-cyclohexylphenyl)amino]-4-oxo-butanoic acid.

Upstream & downstream products

Suppliers94 total

上海康恩博医药科技有限公司17510465506 · [email protected]
苏州道澜生物医药科技有限公司15952404857 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
郑州海阔光电材料有限公司67759225 13526468238 · [email protected]
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

Related reactions

91 records
New reaction record

Compound notes

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