AG00G87N

79247-88-4 | Ethyl 4,5-dimethyl-1,3-thiazole-2-carboxylate

AG00G87N

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CAS Number	79247-88-4
Catalog Number	AG00G87N(AGN-PC-0ECL5N)
Chemical Name	Ethyl 4,5-dimethyl-1,3-thiazole-2-carboxylate
IUPAC Name	ethyl 4-ethyl-1,3-thiazole-2-carboxylate
InChI	InChI=1S/C8H11NO2S/c1-3-6-5-12-7(9-6)8(10)11-4-2/h5H,3-4H2,1-2H3
InChI Key	SZBLTQUPTGKZAV-UHFFFAOYSA-N
MDL Number	MFCD11520453
Molecular Formula	C8H11NO2S
Molecular Weight	185.2434
SMILES	O=C(C1=NC(CC)=CS1)OCC
Synonyms	Ethyl 4-ethylthiazole-2-carboxylate, 79247-88-4, ethyl 4-ethyl-1,3-thiazole-2-carboxylate, 4-ethyl-thiazole-2-carboxylic acid ethyl ester, SCHEMBL2594514, SZBLTQUPTGKZAV-UHFFFAOYSA-N, KS-000023SG, MFCD11520453, ZINC50182043, AKOS011316999, CF-0753, MCULE-5767551023, AJ-111549, 2-Thiazolecarboxylicacid,4-ethyl-,ethylester, Z-6240, 2-Thiazolecarboxylic acid, 4-ethyl-, ethyl ester,

Complexity	163
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	185.051g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	185.241g/mol
Monoisotopic Mass	185.051g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	67.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2.3

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H317-H319
Packing Group
Precautionary statements	P280-P305+P351+P338
UN Code

Certificate of Analysis

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