AG002KVR

5932-27-4 | 1H-Pyrazole-3-carboxylic acid, ethyl ester

AG002KVR

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CAS Number	5932-27-4
Catalog Number	AG002KVR(AGN-PC-0OCVUK)
Chemical Name	1H-Pyrazole-3-carboxylic acid, ethyl ester
IUPAC Name	ethyl 1H-pyrazole-5-carboxylate
InChI	InChI=1S/C6H8N2O2/c1-2-10-6(9)5-3-4-7-8-5/h3-4H,2H2,1H3,(H,7,8)
InChI Key	MSPOSRHJXMILNK-UHFFFAOYSA-N
MDL Number	MFCD00159643
Molecular Formula	C6H8N2O2
Molecular Weight	140.1399
SMILES	O=C(C1=NNC=C1)OCC
Synonyms	ethyl 1H-pyrazole-3-carboxylate, 5932-27-4, ethyl 1H-pyrazole-5-carboxylate, Ethyl pyrazole-3-carboxylate, Ethyl 3-Pyrazolecarboxylate, 21056-77-9, 2H-Pyrazole-3-carboxylic acid ethyl ester, 1H-PYRAZOLE-3-CARBOXYLIC ACID, ETHYL ESTER, 1H-pyrazole-3-carboxylic acid ethyl ester, ethyl 2H-pyrazole-3-carboxylate, ethyl-1H-pyrazole-3-carboxylate, PYRAZOLE-3-CARBOXYLIC ACID ETHYL ESTER, ethyl pyrazole-5-carboxylate, Ethylpyrazole-3-carboxylate, ethoxycarbonylpyrazole, AC1OGECV, PubChem19209, PubChem23654, ACMC-209mcd, ethyl pyrazolecarboxylate, 3-(Ethoxycarbonyl)pyrazole, ethyl 5-pyrazolecarboxylate, Ethyl-pyrazole-3-carboxylate, 3-ethoxycarbonyl-1H-pyrazole, SCHEMBL561497, ethyl1H-pyrazole-5-carboxylate, TPC-I156, CTK5A9772, CTK6F6947, EBD1433, ethyl 1-H-pyrazole-3-carboxylate, MSPOSRHJXMILNK-UHFFFAOYSA-N, BH804, Ethyl 3-pyrazolecarboxylate, 97%, AC1Q3498, ACN-P000648, ACN-P000876, ACT01782, ALBB-003650, BCP27070, KS-000008DX, 0764AB, ANW-33227, ANW-60151, BBL005520, ethyl 1H-pyrazole-5(3)-carboxylate, FC0940, GEO-01374, MFCD00159643, SBB017331, STK298844, ZINC18161725, AKOS000305755, AKOS003237385, AB06196, AC-6411, AN-2333, AS-5621, AS-8696, CS-W002460, MCULE-4192977461, PB27452, RP08825, TRA0033821, 2H-pyrazole-3-carboxylic acid ethylester, AJ-70374, AK-45333, BR-45333, CJ-15844, DA-43287, SC-44242, SC-68538, ST078295, SY012805, 1H-Pyrazole-3-carboxylicacid, ethyl ester, 1H-Pyrazole-5-carboxylic acid ethyl ester, 2 h-pyrazole-3-carboxylic acid ethyl ester, AB0003394, AJ-127839, DB-026603, ST2419288, TR-020587, TR-072161, AM20100443, BB 0237568, BB 0259275, E0965, FT-0083511, FT-0650139, FT-0729179, W7230, EN300-30585, MFCD00159643 (98%), C-5709, 932P274, I14-0427, W-200448, F2145-1022, F2146-0642, 1H-pyrazole-3-carboxylicacid, C6H8N2O2, Ethyl1H-pyrazole-3-carboxylate, ZINC04243791, ACN-000648, CID7147518, Pyrazole-3-carboxylic acid, ethyl ester, 73121-56-9,

Complexity	127
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	140.059g/mol
Formal Charge	0
Heavy Atom Count	10
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	140.142g/mol
Monoisotopic Mass	140.059g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	55A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319-H332-H335
Packing Group
Precautionary statements	P261-P280-P305+P351+P338
UN Code

Certificate of Analysis

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