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Benzothiazole,6-chloro-2-methyl-

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Name

Benzothiazole,6-chloro-2-methyl-

EINECS N/A
CAS No. 4146-24-1 Density 1.365 g/cm3
PSA 41.13000 LogP 3.25810
Solubility N/A Melting Point N/A
Formula C8H6ClNS Boiling Point 276.8 °C at 760mmHg
Molecular Weight 183.661 Flash Point 121.2 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 4146-24-1 (6-Chloro-2-methyl-benzothiazole) Hazard Symbols N/A
Synonyms

2-Methyl-6-chlorobenzothiazole;6-Chloro-2-methylbenzothiazole;

Article Data 4

Benzothiazole,6-chloro-2-methyl- Specification

The Benzothiazole,6-chloro-2-methyl- is an organic compound with the molecular formula C8H6ClNS. Its CAS registry number is 4146-24-1. The IUPAC name of this chemical is called 6-Chloro-2-methyl-1,3-benzothiazole. It belongs to the product categories of Benzothiazole. What's more, the molecular weight of this chemical is 183.65794.

Physical properties about Benzothiazole,6-chloro-2-methyl- are: (1)ACD/LogP: 3.00; (2)#of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 41.13 Å2; (7)Index of Refraction: 1.67; (8)Molar Refractivity: 50.29 cm3; (9)Molar Volume: 134.4 cm3; (10)Polarizability: 19.93×10-24 cm3; (11)Surface Tension: 52.4 dyne/cm; (12)Density: 1.365 g/cm3; (13)Flash Point: 121.2 °C; (14)Enthalpy of Vaporization: 49.46 kJ/mol; (15)Boiling Point: 276.8 °C at 760 mmHg; (16)Vapour Pressure: 0.0079 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccc2nc(sc2c1)C
(2) InChI: InChI=1/C8H6ClNS/c1-5-10-7-3-2-6(9)4-8(7)11-5/h2-4H,1H3
(3) InChIKey: DGMXMWBHUAEUQK-UHFFFAOYAR

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