2-Amino-3-chlorobenzenethiol supplier

Name
2-AMINO-3-CHLOROTHIOPHENOL
EINECS
CAS No. 40925-72-2
Article Data6
CAS DataBase
Density 1.373 g/cm³
Solubility
Melting Point 78℃
Formula C₆H₆ClNS
Boiling Point 254.908 °C at 760 mmHg
Molecular Weight 159.639
Flash Point 107.965 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Benzenethiol, 2-amino-3-chloro-;2-amino-3-chlorothiophenol;
PSA 64.82000
LogP 2.79210

2-Amino-3-chlorobenzenethiol Specification

The CAS register number of 2-Amino-3-chlorobenzenethiol is 40925-72-2. It also can be called as Benzenethiol, 2-amino-3-chloro- and the systematic name about this chemical is 2-amino-3-chlorobenzenethiol. The molecular formula about this chemical is C₆H₆ClNS and the molecular weight is 159.64.

Physical properties about 2-Amino-3-chlorobenzenethiol are: (1)ACD/LogP: 2.43; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 37; (5)ACD/BCF (pH 7.4): 16; (6)ACD/KOC (pH 5.5): 457; (7)ACD/KOC (pH 7.4): 201; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 64.82Å²; (12)Index of Refraction: 1.672; (13)Molar Refractivity: 43.559 cm³; (14)Molar Volume: 116.275 cm³; (15)Polarizability: 17.268x10^-24cm³; (16)Surface Tension: 55.578 dyne/cm; (17)Enthalpy of Vaporization: 49.236 kJ/mol; (18)Boiling Point: 254.908 °C at 760 mmHg; (19)Vapour Pressure: 0.017 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Sc1cccc(Cl)c1N
(2)InChI: InChI=1/C6H6ClNS/c7-4-2-1-3-5(9)6(4)8/h1-3,9H,8H2
(3)InChIKey: XERMPLQXCQQVGU-UHFFFAOYAV
(4)Std. InChI: InChI=1S/C6H6ClNS/c7-4-2-1-3-5(9)6(4)8/h1-3,9H,8H2
(5)Std. InChIKey: XERMPLQXCQQVGU-UHFFFAOYSA-N

Product Name

2-AMINO-3-CHLOROTHIOPHENOL

2-Amino-3-chlorobenzenethiol Specification

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