2,7-Dichlorobenzothiazole supplier

Name
2,7-Dichlorobenzothiazole
EINECS
CAS No. 2942-23-6
Article Data6
CAS DataBase
Density 1.567 g/cm³
Solubility
Melting Point
Formula C₇H₃Cl₂NS
Boiling Point 286.8 °C at 760 mmHg
Molecular Weight 204.08
Flash Point 127.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 2,7-Dichloro-1,3-benzothiazole;2,7-Dichlorobenzothiazole;
PSA 41.13000
LogP 3.60310

2,7-Dichlorobenzothiazole Specification

The cas register number of Retigeric acid A is 2942-23-6. It also can be called as benzothiazole, 2,7-dichloro- and the Systematic name about this chemical is 2,7-dichloro-1,3-benzothiazole.

Physical properties about Retigeric acid A are: (1)ACD/LogP: 4.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4.01; (4)ACD/LogD (pH 7.4): 4.01; (5)ACD/BCF (pH 5.5): 655.81; (6)ACD/BCF (pH 7.4): 655.81; (7)ACD/KOC (pH 5.5): 3612.87; (8)ACD/KOC (pH 7.4): 3612.87; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 41.13Å²; (13)Index of Refraction: 1.701; (14)Molar Refractivity: 50.36 cm³; (15)Molar Volume: 130.1 cm³; (16)Surface Tension: 58.6 dyne/cm; (17)Density: 1.567 g/cm³; (18)Flash Point: 127.2 °C; (19)Enthalpy of Vaporization: 50.48 kJ/mol; (20)Boiling Point: 286.8 °C at 760 mmHg; (21)Vapour Pressure: 0.00446 mmHg at 25°C.

People can use the following data to convert to the molecule structure.
1.SMILES: Clc1cccc2nc(Cl)sc12
2.InChI: InChI=1/C7H3Cl2NS/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H
3.InChIKey: MBKFIAXHERNXNL-UHFFFAOYAC
4.Std. InChI: InChI=1S/C7H3Cl2NS/c8-4-2-1-3-5-6(4)11-7(9)10-5/h1-3H

Product Name

2,7-Dichlorobenzothiazole

2,7-Dichlorobenzothiazole Specification

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