AG003Q69

121195-03-7 | Ethyl 5-thien-2-yl-1H-pyrazole-3-carboxylate

AG003Q69

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CAS Number	121195-03-7
Catalog Number	AG003Q69(AGN-PC-0KK7UR)
Chemical Name	Ethyl 5-thien-2-yl-1H-pyrazole-3-carboxylate
IUPAC Name	ethyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate
InChI	InChI=1S/C10H10N2O2S/c1-2-14-10(13)8-6-7(11-12-8)9-4-3-5-15-9/h3-6H,2H2,1H3,(H,11,12)
InChI Key	NTCRDZSJYGZRIE-UHFFFAOYSA-N
MDL Number	MFCD07772880
Molecular Formula	C10H10N2O2S
Molecular Weight	222.2636
SMILES	C(=O)(OCC)c1cc([nH]n1)c1cccs1
Synonyms	121195-03-7, ethyl 5-thien-2-yl-1H-pyrazole-3-carboxylate, ethyl 5-(2-thienyl)pyrazole-3-carboxylate, ethyl 3-(thiophen-2-yl)-1H-pyrazole-5-carboxylate, ethyl 5-(thiophen-2-yl)-1H-pyrazole-3-carboxylate, 1H-Pyrazole-3-carboxylic acid, 5-(2-thienyl)-, ethyl ester, 1H-Pyrazole-3-carboxylicacid, 5-(2-thienyl)-, ethyl ester, ACMC-20mpcx, ETHYL 3-(2-THIENYL)-1H-PYRAZOLE-5-CARBOXYLATE, AC1MC5OC, Maybridge1_008811, KSC512E3J, MLS000833954, ARONIS23989, SCHEMBL594734, AC1Q33X0, ARONIS023807, CHEMBL1412959, CTK4B2234, CTK6F7430, HMS566I11, DTXSID60371389, NTCRDZSJYGZRIE-UHFFFAOYSA-N, HMS2803A09, WT630, ACT08532, KS-00000BO8, KS-000046FD, ZINC4277673, ANW-46897, MFCD00099767, SBB053935, STL069473, TD8032, AKOS005111419, AKOS015912139, CS-W014712, MCULE-1301176735, PS-3559, RP27393, TRA0074251, AC-28059, AJ-50118, AK-28748, CJ-22543, SMR000461473, SY018884, TS-00527, Ethyl5-(2-Thienyl)pyrazole-3-carboxylate, AB0035193, AJ-128492, Ethyl 3-(2-thienyl)pyrazole-5-carboxylate, ST2406979, TC-135642, 4CH-018090, FT-0083149, FT-0625984, ST45053142, X9479, Z-4506, ethyl 5-(2-thienyl)-1H-pyrazole-3-carboxylate, MFCD07772880 (97+%), ethyl 5-thiophen-2-yl-1H-pyrazole-3-carboxylate, ethyl 5-(thiophen-2-yl)-2H-pyrazole-3-carboxylate, J-521158, I14-35512, 1H-Pyrazole-3-carboxylicacid,5-(2-thienyl)-,ethyl ester, 3-(2-Thienyl)-1H-pyrazole-5-carboxylic acid ethyl ester, 3-Thiophen-2-yl-1H-pyrazole-5-carboxylic acid ethyl ester, 5-Thiophen-2-yl-2H-pyrazole-3-carboxylic acid ethyl ester, 121195-03-7 ethyl 5-thien-2-yl-1h-pyrazole-3-carboxylate, 5-(Thiophen-2-yl)-1H-pyrazole-3-carboxylic acid ethyl ester, C10H10N2O2S, ZINC04277673, ACN-051811, CID2736478, 4-methyl-6-nitrobenzo[d]thiazol-2-amine, Ethyl 3-(thiophen-2-yl)-1H-pyrazole-5-carboxylate, 97% - 1G 1g, 16586-51-9,

Complexity	238
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	222.046g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	222.262g/mol
Monoisotopic Mass	222.046g/mol
Rotatable Bond Count	4
Topological Polar Surface Area	83.2A^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-H312-H332
Packing Group
Precautionary statements	P280
UN Code

Certificate of Analysis

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