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CAS No.: | 32631-29-1 |
---|---|
Name: | 4-AMINO-4'-CHLORO DIPHENYL SULFIDE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C12H10ClNS |
Molecular Weight: | 235.737 |
Synonyms: | Aniline,p-[(p-chlorophenyl)thio]- (6CI,8CI);4-(4-Chlorophenylsulfanyl)aniline;4-(4-Chlorophenylsulfanyl)phenylamine;4-(4-Chlorophenylthio)aniline;4-Amino-4'-chlorodiphenyl sulfide;p-Aminophenyl p-chlorophenyl sulfide;p-[(p-Chlorophenyl)thio]aniline;p-[(p-Chlorophenyl)thio]benzenamine; |
Density: | 1.31 g/cm3 |
Melting Point: | 54.7-56.5 °C |
Boiling Point: | 420.1 °C at 760 mmHg |
Flash Point: | 207.9 °C |
PSA: | 51.32000 |
LogP: | 4.65460 |
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The CAS register number of Benzenamine,4-[(4-chlorophenyl)thio]- is 32631-29-1. It also can be called as 4-Amino-4'-chlorodiphenyl sulfide and the systematic name about this chemical is 4-[(4-chlorophenyl)sulfanyl]aniline. The molecular formula about this chemical is C12H10ClNS and the molecular weight is 235.73.
Physical properties about Benzenamine,4-[(4-chlorophenyl)thio]- are: (1)ACD/LogP: 4.15; (2)ACD/LogD (pH 5.5): 4.14; (3)ACD/LogD (pH 7.4): 4.15; (4)ACD/BCF (pH 5.5): 828.56; (5)ACD/BCF (pH 7.4): 836.48; (6)ACD/KOC (pH 5.5): 4259.42; (7)ACD/KOC (pH 7.4): 4300.11; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 51.32Å2; (12)Index of Refraction: 1.683; (13)Molar Refractivity: 67.91 cm3; (14)Molar Volume: 178.9 cm3; (15)Polarizability: 26.92x10-24cm3; (16)Surface Tension: 58.4 dyne/cm; (17)Flash Point: 207.9 °C; (18)Enthalpy of Vaporization: 67.39 kJ/mol; (19)Boiling Point: 420.1 °C at 760 mmHg; (20)Vapour Pressure: 2.89E-07 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(Sc1ccc(N)cc1)cc2
(2)InChI: InChI=1/C12H10ClNS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2
(3)InChIKey: DVTZWUZZYSGZLE-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C12H10ClNS/c13-9-1-5-11(6-2-9)15-12-7-3-10(14)4-8-12/h1-8H,14H2
(5)Std. InChIKey: DVTZWUZZYSGZLE-UHFFFAOYSA-N