AG0052C3

81449-93-6 | Ethyl 2-chlorothiazole-5-carboxylate

AG0052C3

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CAS Number	81449-93-6
Catalog Number	AG0052C3(AGN-PC-025FNY)
Chemical Name	Ethyl 2-chlorothiazole-5-carboxylate
IUPAC Name	ethyl 2-chloro-1,3-thiazole-5-carboxylate
InChI	InChI=1S/C6H6ClNO2S/c1-2-10-5(9)4-3-8-6(7)11-4/h3H,2H2,1H3
InChI Key	IZIJOEOJKFKHQR-UHFFFAOYSA-N
MDL Number	MFCD08703267
Molecular Formula	C6H6ClNO2S
Molecular Weight	191.6353
SMILES	ClC1=NC=C(S1)C(=O)OCC
Synonyms	Ethyl 2-chlorothiazole-5-carboxylate, 81449-93-6, Ethyl2-chloro-5-thiazolecarboxylate, ethyl 2-chloro-1,3-thiazole-5-carboxylate, Ethyl 2-chloro-5-thiazolecarboxylate, 5-Thiazolecarboxylicacid, 2-chloro-, ethyl ester, 5-THIAZOLECARBOXYLIC ACID, 2-CHLORO-, ETHYL ESTER, MFCD08703267, PubChem15942, SCHEMBL285761, CTK5E8802, DTXSID90597419, ethyl 2-chlorothiazole-5-formate, IZIJOEOJKFKHQR-UHFFFAOYSA-N, ACT08902, ANW-50522, CE-478, CL2507, ZINC40448588, AKOS006288561, AB48458, AC-7540, AN-8888, CS-W022658, FS-2772, QC-6405, RP25119, KS-00000G69, AK-24491, BR-24491, SY007665, AB0007515, AJ-102846, DB-000700, ST2412936, TR-025609, A9992, AM20100794, FT-0650278, W8583, 2-Chloro-5-thiazolecarboxylic acid ethyl ester, 2-Chlorothiazole-5-carboxylic acid ethyl ester, S-2630, 449E936, I09-1292, J-520741, 2-CHLORO-THIAZOLE-5-CARBOXYLIC ACID ETHYL ESTER, C6H6ClNO2S, 2-chloro-1,3-thiazole-5-carboxylic Acid, C2875, 6-Allyl-N-[3-(dimethylamino)propyl]-N-(ethylcarbamoyl)ergoline-8-carboxamide,

Complexity	156
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	190.981g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	191.629g/mol
Monoisotopic Mass	190.981g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	67.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.5

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H335
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

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