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23474-98-8

Basic Information
CAS No.: 23474-98-8
Name: 2-AMINO-5-CHLOROTHIOPHENOL
Article Data: 34
Molecular Structure:
Molecular Structure of 23474-98-8 (2-AMINO-5-CHLOROTHIOPHENOL)
Formula: C6H6ClNS
Molecular Weight: 159.639
Synonyms: 2-Amino-5-chlorobenzenethiol;2-Amino-5-chlorothiophenol;4-Chloro-2-mercaptoaniline;5-Chloro-2-aminobenzenethiol;5-Chloro-2-aminothiophenol;
Density: 1.372 g/cm3
Melting Point: 110 °C
Boiling Point: 278 °C at 760 mmHg
Flash Point: 121.9 °C
Hazard Symbols: IrritantXi
Risk Codes: 20/21/22-36/37/38
Safety: 26-36/37/39
PSA: 64.82000
LogP: 2.79210
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  • Benzenethiol,2-amino-5-chloro-

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Specification

The Benzenethiol,2-amino-5-chloro-, with the CAS registry number 23474-98-8, is also known as 2-amino-5-chlorobenzene-1-thiol. This chemical's molecular formula is C6H6ClNS and molecular weight is 159.64. Its systematic name is called 2-amino-5-chlorobenzenethiol. 

Physical properties of Benzenethiol,2-amino-5-chloro-: (1)ACD/LogP: 2.23; (2)ACD/LogD (pH 5.5): 2.09; (3)ACD/LogD (pH 7.4): 1.8; (4)ACD/BCF (pH 5.5): 20.93; (5)ACD/BCF (pH 7.4): 10.82; (6)ACD/KOC (pH 5.5): 278.88; (7)ACD/KOC (pH 7.4): 144.17; (8)#H bond acceptors: 1; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Index of Refraction: 1.672; (12)Molar Refractivity: 43.55 cm3; (13)Molar Volume: 116.2 cm3; (14)Surface Tension: 55.5 dyne/cm; (15)Density: 1.372 g/cm3; (16)Flash Point: 121.9 °C; (17)Enthalpy of Vaporization: 51.66 kJ/mol; (18)Boiling Point: 278 °C at 760 mmHg; (19)Vapour Pressure: 0.00438 mmHg at 25°C.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is harmful by inhalation, in contact with skin and if swallowed. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing, gloves and eye/face protection.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1cc(S)c(N)cc1
(2)InChI: InChI=1/C6H6ClNS/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2
(3)InChIKey: TYRZAGMAVZESQX-UHFFFAOYAF