AG00FGCV

7251-53-8 | Ethyl 3-hydroxy-1H-pyrazole-4-carboxylate

AG00FGCV

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CAS Number	7251-53-8
Catalog Number	AG00FGCV(AGN-PC-0JOEGH)
Chemical Name	Ethyl 3-hydroxy-1H-pyrazole-4-carboxylate
IUPAC Name	ethyl 3-oxo-1,2-dihydropyrazole-4-carboxylate
InChI	InChI=1S/C6H8N2O3/c1-2-11-6(10)4-3-7-8-5(4)9/h3H,2H2,1H3,(H2,7,8,9)
InChI Key	PJFXDPZWCVXNQZ-UHFFFAOYSA-N
MDL Number	MFCD16619878
Molecular Formula	C6H8N2O3
Molecular Weight	156.1393
SMILES	O=C(C1=CNN=C1O)OCC
Synonyms	7251-53-8, ethyl 3-hydroxy-1H-pyrazole-4-carboxylate, ethyl 5-hydroxy-1h-pyrazole-4-carboxylate, 3-Hydroxy-1H-pyrazole-4-carboxylic acid ethyl ester, Ethyl 3-Oxo-2,3-dihydro-1H-pyrazole-4-carboxylate, MLS000766203, ethyl 3-hydroxypyrazole-4-carboxylate, 1H-Pyrazole-4-carboxylic acid, 2,3-dihydro-3-oxo-, ethyl ester, 3-hydroxypyrazole-4-carboxylic acid ethyl ester, NSC43546, YLIC ACID ETHYL, RAZOLE-4-CARBOX, 3-HYDROXY-1H-PY, AC1Q6D4F, AC1L622T, SCHEMBL1209767, CHEMBL1403762, SCHEMBL20641707, CTK5D6320, CTK6F5723, DTXSID90286038, PJFXDPZWCVXNQZ-UHFFFAOYSA-N, 3-hydroxy-4-ethoxycarbonylpyrazole, HMS2885D06, HMS3437C17, KS-00000S4A, ZINC1587338, MFCD12131138, NSC-43546, NSC370392, SBB087129, AKOS001782278, AKOS015838793, AKOS028108629, AS-5220, CS-W018871, MCULE-4270383034, NSC-370392, AJ-27601, AK146182, AM804286, ethyl 3-hydroxy-1H-pyrazol-4-carboxylate, SMR000528837, SY018525, TS-00083, TR-072083, MFCD16619878 (95%), ethyl 3-oxo-1,2-dihydropyrazole-4-carboxylate, 3-Hydroxy-2H-pyrazole-4-carboxylic acid ethyl ester, I14-12170, F2147-9815, Z1954803823, 3-Oxo-2,3-dihydro-1H-pyrazole-4-carboxylic acid ethyl ester, 1H-Pyrazole-4-carboxylicacid, 2,3-dihydro-3-oxo-, ethyl ester, Ester, AR-1I9439, CID238933, ACN-025073, (2-tert-butoxy-2-oxoethyl)zinc(II) bromide, 3-HYDROXY-1H-PYRAZOLE-4-CARBOXYLIC ACID ETHYLESTER, 93787-99-6,

Complexity	222
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	156.053g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	156.141g/mol
Monoisotopic Mass	156.053g/mol
Rotatable Bond Count	3
Topological Polar Surface Area	67.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.2

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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