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2-Chloro-5-methoxybenzothiazole

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Name

2-Chloro-5-methoxybenzothiazole

EINECS N/A
CAS No. 3507-28-6 Density 1.404 g/cm3
PSA 50.36000 LogP 2.95830
Solubility N/A Melting Point N/A
Formula C8H6ClNOS Boiling Point 293.5 °C at 760 mmHg
Molecular Weight 199.661 Flash Point 131.3 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 3507-28-6 (Benzothiazole, 2-chloro-5-methoxy- (6CI,7CI,8CI,9CI)) Hazard Symbols N/A
Synonyms

2-Chloro-5-methoxybenzothiazole;

Article Data 5

2-Chloro-5-methoxybenzothiazole Specification

The 2-Chloro-5-methoxybenzothiazole ,its cas register number is 3507-28-6.It also can be called as Benzothiazole,2-chloro-5-methoxy- and the Systematic name about this chemicals is 2-Chloro-5-methoxy-1,3-benzothiazole .It belongs to the Benzothiazole.

Following are the chemical properties about 2-Chloro-5-methoxybenzothiazole :(1)#H bond acceptors: 2 ; (2)#H bond donors: 0 ; (3)#Freely Rotating Bonds: 1 ; (4)Polar Surface Area: 50.36 Å2 ; (5)Index of Refraction: 1.654; (6)Molar Refractivity: 52.14 cm3 ; (7)Molar Volume: 142.2 cm3 ; (8)Polarizability: 20.67x10-24cm3 ; (9)Surface Tension: 51.5 dyne/cm ; (10)Enthalpy of Vaporization: 51.17 kJ/mol ; (11)Vapour Pressure: 0.00301 mmHg at 25°C

This chemicals can be described computed from structure:
(1)SMILES: Clc1nc2cc(OC)ccc2s1
(2)InChI: InChI=1/C8H6ClNOS/c1-11-5-2-3-7-6(4-5)10-8(9)12-7/h2-4H,1H3
(3)InChIKey: UUERHMFUYYXLRE-UHFFFAOYAL
(4)Std. InChI: InChI=1S/C8H6ClNOS/c1-11-5-2-3-7-6(4-5)10-8(9)12-7/h2-4H,1H3
(5)Std. InChIKey: UUERHMFUYYXLRE-UHFFFAOYSA-N

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