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1821-36-9

1821-36-9 Structure

1821-36-9 Structure
IdentificationMore
[Name]

N-CYCLOHEXYLANILINE
[CAS]

1821-36-9
[Synonyms]

N1-CYCLOHEXYLANILINE
N-CYCLOHEXYLANILINE
N-PHENYLCYCLOHEXYLAMINE
PHENYL CYCLOHEXYLAMINE
Aniline, N-cyclohexyl-
Benzenamine, N-cyclohexyl-
Cyclohexanamine, N-phenyl-
Cyclohexylamine, N-phenyl-
Cyclohexylphenylamine
Diphenylamine, ar-hexahydro-
n-cyclohexyl-benzenamin
N-Cyclohexylbenzenamine
N-Cyclohexyl-N-phenylamine
N-Phenylcyclohexanamine
[EINECS(EC#)]

217-344-4
[Molecular Formula]

C12H17N
[MDL Number]

MFCD00014284
[Molecular Weight]

175.27
[MOL File]

1821-36-9.mol
Chemical PropertiesBack Directory
[Appearance]

dark brown liquid
[Melting point ]

14-15°C
[Boiling point ]

191-192 °C (73 mmHg)
[density ]

0.996 g/mL at 20 °C(lit.)
[refractive index ]

n20/D 1.560
[Fp ]

136 °C
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[form ]

liquid
[pka]

5.46±0.20(Predicted)
[color ]

Orange
[Water Solubility ]

Not miscible or difficult to mix in water.
[BRN ]

2209864
[InChI]

InChI=1S/C12H17N/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2
[InChIKey]

TXTHKGMZDDTZFD-UHFFFAOYSA-N
[SMILES]

C1(NC2CCCCC2)=CC=CC=C1
[CAS DataBase Reference]

1821-36-9(CAS DataBase Reference)
[EPA Substance Registry System]

N-Cyclohexylaniline (1821-36-9)
Safety DataBack Directory
[Hazard Codes ]

Xn
[Risk Statements ]

R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
[Safety Statements ]

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S36/37:Wear suitable protective clothing and gloves .
[WGK Germany ]

3
[TSCA ]

Yes
[HS Code ]

29214900
[Storage Class]

6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
[Hazard Classifications]

Acute Tox. 2 Inhalation
Acute Tox. 4 Oral
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Chemical Properties]

dark brown liquid
[Uses]

N-Cyclohexylaniline has been used as reagent in palladium-catalyzed amination of aromatic bromides.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 50, p. 1927, 1985 DOI: 10.1021/jo00211a028
Synthetic Communications, 19, p. 565, 1989
Tetrahedron Letters, 16, p. 119, 1975
Spectrum DetailBack Directory
[Spectrum Detail]

N-Cyclohexylaniline(1821-36-9)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

N-Cyclohexylaniline, 98%(1821-36-9)
[Alfa Aesar]

N-Cyclohexylaniline, 98%(1821-36-9)
[Sigma Aldrich]

1821-36-9(sigmaaldrich)
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