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CAS No.: | 1205-40-9 |
---|---|
Name: | (2-CHLORO-PHENYL)-PHENYL-AMINE |
Article Data: | 32 |
Molecular Structure: | |
Formula: | C12H10ClN |
Molecular Weight: | 203.671 |
Synonyms: | Diphenylamine,2-chloro- (6CI,8CI);2-Chloro-N-phenylaniline;2-Chlorodiphenylamine;N-(o-Chlorophenyl)aniline;N-Phenyl-2-chloroaniline; |
Density: | 1.216 g/cm3 |
Melting Point: | 100-101℃ |
Boiling Point: | 304 °C at 760 mmHg |
Flash Point: | 137.6 °C |
PSA: | 12.03000 |
LogP: | 4.15660 |
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The Benzenamine,2-chloro-N-phenyl-, with the CAS registry number 1205-40-9, is also known as N-Phenyl-2-chloroaniline. This chemical's molecular formula is C12H10ClN and molecular weight is 203.67. What's more, its systematic name is 2-chloro-N-phenylaniline.
Physical properties of Benzenamine,2-chloro-N-phenyl- are: (1)ACD/LogP: 3.86; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.86; (4)ACD/LogD (pH 7.4): 3.86; (5)ACD/BCF (pH 5.5): 509.24; (6)ACD/BCF (pH 7.4): 509.24; (7)ACD/KOC (pH 5.5): 3014.5; (8)ACD/KOC (pH 7.4): 3014.5; (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)Polarizability: 23.99×10-24cm3; (17)Surface Tension: 46.1 dyne/cm; (18)Density: 1.216 g/cm3; (19)Flash Point: 137.6 °C; (20)Enthalpy of Vaporization: 54.43 kJ/mol; (21)Boiling Point: 304 °C at 760 mmHg; (22)Vapour Pressure: 0.000899 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccccc2Nc1ccccc1
(2)InChI: InChI=1S/C12H10ClN/c13-11-8-4-5-9-12(11)14-10-6-2-1-3-7-10/h1-9,14H
(3)InChIKey: CASDLXCHUTYPAO-UHFFFAOYSA-N