Methyl 2-(chloromethyl)thiazole-4-carboxylate supplier

Name
4-Thiazolecarboxylicacid,2-(chloromethyl)-,methylester(9CI)
EINECS
CAS No. 321371-29-3
Article Data4
CAS DataBase
Density 1.391g/cm³
Solubility
Melting Point
Formula C₆H₆ClNO₂S
Boiling Point 261.2°Cat760mmHg
Molecular Weight 191.638
Flash Point 111.8°C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Methyl2-(chloromethyl)-1,3-thiazole-4-carboxylate;
PSA 67.43000
LogP 1.66850

Methyl 2-(chloromethyl)thiazole-4-carboxylate Specification

The Methyl 2-(chloromethyl)thiazole-4-carboxylate with cas registry number of 321371-29-3, belongs to the following product categories thiazole. And it is also named 4-Thiazolecarboxylicacid,2-(chloromethyl)-,methylester(9CI); 4-thiazolecarboxylic acid, 2-(chloromethyl)-, methyl ester.

Physical properties about this chemical are: (1)ACD/LogP: 1.31; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.31; (4)ACD/LogD (pH 7.4): 1.31; (5)#H bond acceptors: 3; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 3; (8)Polar Surface Area: 67.43 Å²; (9)Index of Refraction: 1.555; (10)Molar Refractivity: 44.26 cm³; (11)Molar Volume: 137.7 cm³; (12)Polarizability: 17.54×10^-24cm³; (13)Surface Tension: 49.1 dyne/cm; (14)Enthalpy of Vaporization: 49.89 kJ/mol; (15)Vapour Pressure: 0.0117 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES:COC(=O)c1csc(n1)CCl;
(2)InChI:InChI=1/C6H6ClNO2S/c1-10-6(9)4-3-11-5(2-7)8-4/h3H,2H2,1H3;
(3)InChIKey:SRDRWIMXEFYHIK-UHFFFAOYAT;
(4)Std. InChI:InChI=1S/C6H6ClNO2S/c1-10-6(9)4-3-11-5(2-7)8-4/h3H,2H2,1H3;
(5)Std. InChIKey:SRDRWIMXEFYHIK-UHFFFAOYSA-N

Product Name

4-Thiazolecarboxylicacid,2-(chloromethyl)-,methylester(9CI)

Methyl 2-(chloromethyl)thiazole-4-carboxylate Specification

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