CAS No.1205-71-6,4-CHLORODIPHENYLAMINE Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1205-71-6
Name:	4-CHLORODIPHENYLAMINE
Article Data:	114

Formula:	C₁₂H₁₀ClN
Molecular Weight:	203.671
Synonyms:	Diphenylamine,4-chloro- (6CI,8CI);4-Chloro-N-phenylaniline;4-Chloro-N-phenylbenzenamine;4-Chlorodiphenylamine;N-(4-Chlorophenyl)benzenamine;N-Phenyl-4-chloroaniline;N-p-Chlorophenylaniline;NSC 231508;p-Anilinochlorobenzene;p-Chlorodiphenylamine;
Density:	1.216 g/cm³
Melting Point:	74°C
Boiling Point:	323.8 °C at 760 mmHg
Flash Point:	149.7 °C
PSA:	12.03000
LogP:	4.15660

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Specification

The Benzenamine, 4-chloro-N-phenyl-, with the CAS registry number of 1205-71-6, is also known as 4-Chlorodiphenylamine. This chemical's molecular formula is C₁₂H₁₀ClN and molecular weight is 203.67. What's more, its IUPAC name is 4-Chloro-N-phenylaniline.

Physical properties about Benzenamine, 4-chloro-N-phenyl- are: (1)ACD/LogP: 3.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.96; (4)ACD/LogD (pH 7.4): 3.96; (5)ACD/BCF (pH 5.5): 601.33; (6)ACD/BCF (pH 7.4): 601.34; (7)ACD/KOC (pH 5.5): 3395.42; (8)ACD/KOC (pH 7.4): 3395.44; (9)#H bond acceptors: 1; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 3.24 Å²; (13)Index of Refraction: 1.642; (14)Molar Refractivity: 60.52 cm³; (15)Molar Volume: 167.4 cm³; (16)Surface Tension: 46.1 dyne/cm; (17)Density: 1.216 g/cm³; (18)Flash Point: 149.7 °C; (19)Enthalpy of Vaporization: 56.58 kJ/mol; (20)Boiling Point: 323.8 °C at 760 mmHg; (21)Vapour Pressure: 0.000255 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc2ccc(Nc1ccccc1)cc2
(2) InChI: InChI=1/C12H10ClN/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,14H
(3) InChIKey: VPRIGCVCJPKVFZ-UHFFFAOYAS