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1821-36-9

Basic Information
CAS No.: 1821-36-9
Name: N-CYCLOHEXYLANILINE
Article Data: 377
Molecular Structure:
Molecular Structure of 1821-36-9 (N-CYCLOHEXYLANILINE)
Formula: C12H17N
Molecular Weight: 175.274
Synonyms: Cyclohexylamine,N-phenyl- (6CI,7CI,8CI);Cyclohexanamine, N-phenyl-;Cyclohexylphenylamine;N-Cyclohexyl-N-phenylamine;N-Cyclohexylaniline;N-Cyclohexylbenzenamine;N-Phenylcyclohexylamine;NSC 27510;Phenylcyclohexylamine;
EINECS: 217-344-4
Density: 1.022 g/cm3
Melting Point: 14-15 °C
Boiling Point: 292.9 °C at 760 mmHg
Flash Point: 135.5 °C
Solubility: Not miscible or difficult to mix in water.
Appearance: dark brown liquid
Hazard Symbols: HarmfulXn
Risk Codes: 20/21/22
Safety: 23-36/37
PSA: 12.03000
LogP: 3.50420
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  • Benzenamine,N-cyclohexyl-

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    Benzenamine,N-cyclohexyl-

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Specification

The Benzenamine,N-cyclohexyl-, with the CAS registry number 1821-36-9, is also known as Diphenylamine, ar-hexahydro-. It belongs to the product categories of Pharmacetical; Benzene Series. Its EINECS registry number is 217-344-4. This chemical's molecular formula is C12H17N and molecular weight is 175.27. Its IUPAC name is called N-cyclohexylaniline. In addition, the product should be sealed and stored in cool, dry place. What's more, it should be protected from strong oxides.

Physical properties of Benzenamine,N-cyclohexyl-: (1)ACD/LogP: 3.66; (2)ACD/LogD (pH 5.5): 3.38; (3)ACD/LogD (pH 7.4): 3.65; (4)ACD/BCF (pH 5.5): 185.68; (5)ACD/BCF (pH 7.4): 348.98; (6)ACD/KOC (pH 5.5): 1219.85; (7)ACD/KOC (pH 7.4): 2292.67; (8)#H bond acceptors: 1; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.578; (12)Molar Refractivity: 56.89 cm3; (13)Molar Volume: 171.3 cm3; (14)Surface Tension: 40.9 dyne/cm; (15)Density: 1.022 g/cm3; (16)Flash Point: 135.5 °C; (17)Enthalpy of Vaporization: 53.25 kJ/mol; (18)Boiling Point: 292.9 °C at 760 mmHg; (19)Vapour Pressure: 0.00178 mmHg at 25°C.

Preparation of Benzenamine,N-cyclohexyl-: this chemical can be prepared by N-cyclohexylidene-aniline. This reaction will need reagents benzene and CO. The reaction pressure is min with reaction temperature of 135 - 140 °C.

Benzenamine,N-cyclohexyl- can be prepared by N-cyclohexylidene-aniline

Uses of Benzenamine,N-cyclohexyl-: it can be used to produce N-cyclohexyl-N-phenyl-urea at ambient temperature. This reaction will need reagent CF3CO2H and solvent benzene with reaction time of 5 hours. The yield is about 93.8%.

Benzenamine,N-cyclohexyl- can be used to produce N-cyclohexyl-N-phenyl-urea

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful by inhalation, in contact with skin and if swallowed. In addition, you should not breathe its gas/fumes/vapour/spray (appropriate wording to be specified by the manufacturer). Whenever you will contact it, please wear suitable protective clothing and gloves.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1CCC(CC1)NC2=CC=CC=C2
(2)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
(3)InChIKey: TXTHKGMZDDTZFD-UHFFFAOYSA-N