CAS No.101012-12-8,2-CHLORO-1,3-THIAZOLE-5-CARBOXYLIC ACID Suppliers

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Basic Information

Molecular Structure:
CAS No.:	101012-12-8
Name:	2-CHLORO-1,3-THIAZOLE-5-CARBOXYLIC ACID

Formula:	C₄H₂ClNO₂S
Molecular Weight:	163.584
Synonyms:	2-CHLORO-1,3-THIAZOLE-5-CARBOXYLIC ACID;2-Chloro-1,3-thiazole-5-carboxylic acid 97%;2-CHLOROTHIAZOLE-5-CARBOXYLICACID;2-Chloro-5-carboxy-1,3-thiazole;2-chloro-thiazol-5-carboxylic acid;5-Carboxy-2-chloro-1,3-thiazole
Density:	1.693 g/cm³
Melting Point:	165.5-167 °C
Boiling Point:	370.2 °C at 760 mmHg
Flash Point:	177.7 °C
PSA:	78.43000
LogP:	1.49470

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Specification

The 5-Thiazolecarboxylicacid, 2-chloro-, with the CAS registry number 101012-12-8, is also known as 2-Chloro-1,3-thiazole-5-carboxylic acid 97%. It belongs to the product categories of Thiazole Series; Building Blocks; Thiazole. This chemical's molecular formula is C₄H₂ClNO₂S and molecular weight is 163.58218. Its IUPAC name is called 2-chloro-1,3-thiazole-5-carboxylic acid.

Physical properties of 5-Thiazolecarboxylicacid, 2-chloro-: (1)ACD/LogP: 0.67; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 3; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 1; (9)Index of Refraction: 1.634; (10)Molar Refractivity: 34.55 cm³; (11)Molar Volume: 96.6 cm³; (12)Surface Tension: 73.1 dyne/cm; (13)Density: 1.693 g/cm³; (14)Flash Point: 177.7 °C; (15)Enthalpy of Vaporization: 65.1 kJ/mol; (16)Boiling Point: 370.2 °C at 760 mmHg; (17)Vapour Pressure: 3.9E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=C(SC(=N1)Cl)C(=O)O
(2)InChI: InChI=1S/C4H2ClNO2S/c5-4-6-1-2(9-4)3(7)8/h1H,(H,7,8)
(3)InChIKey: HNJOKQPEJIWTRF-UHFFFAOYSA-N