AG003QAJ

439692-05-4 | Ethyl 4-cyclopropyl-1,3-thiazole-2-carboxylate

AG003QAJ

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CAS Number	439692-05-4
Catalog Number	AG003QAJ(AGN-PC-09SGGX)
Chemical Name	Ethyl 4-cyclopropyl-1,3-thiazole-2-carboxylate
IUPAC Name	ethyl 4-cyclopropyl-1,3-thiazole-2-carboxylate
InChI	InChI=1S/C9H11NO2S/c1-2-12-9(11)8-10-7(5-13-8)6-3-4-6/h5-6H,2-4H2,1H3
InChI Key	WIYBXTNEMTVQBH-UHFFFAOYSA-N
MDL Number	MFCD01657678
Molecular Formula	C9H11NO2S
Molecular Weight	197.2541
SMILES	O=C(C1=NC(C2CC2)=CS1)OCC
Synonyms	Ethyl 4-cyclopropylthiazole-2-carboxylate, 439692-05-4, ETHYL 4-CYCLOPROPYL-1,3-THIAZOLE-2-CARBOXYLATE, SCHEMBL577947, CTK4I7901, KS-00000BDI, DTXSID10693907, WIYBXTNEMTVQBH-UHFFFAOYSA-N, 6773AJ, MFCD11656780, ZINC42684232, AKOS013217802, AN-9295, RP25540, TRA0044878, Ethyl4-Cyclopropylthiazole-2-carboxylate, AK-31701, QC-10106, SC-27545, SY004308, TS-00318, AB0056206, AB1000072, AJ-104471, TC-308288, 4CH-002064, FT-0687513, ST24047032, K-8931, MFCD11656780 (95+%), 4-Cyclopropyl-thiazole-2-carboxylic acid ethyl ester, J-521007, I14-17569, null, C9H11NO2S, 1191-15-7,

Complexity	206
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	197.051g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	197.252g/mol
Monoisotopic Mass	197.051g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	67.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.1

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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