AG0007LG

10250-59-6 | 1H-Pyrazole-5-carboxylic acid, 1,3-dimethyl-, methyl ester

AG0007LG

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CAS Number	10250-59-6
Catalog Number	AG0007LG(AGN-PC-0NI4GP)
Chemical Name	1H-Pyrazole-5-carboxylic acid, 1,3-dimethyl-, methyl ester
IUPAC Name	methyl 2,5-dimethylpyrazole-3-carboxylate
InChI	InChI=1S/C7H10N2O2/c1-5-4-6(7(10)11-3)9(2)8-5/h4H,1-3H3
InChI Key	KYQGPXFQWUSRMY-UHFFFAOYSA-N
MDL Number	MFCD06204177
Molecular Formula	C7H10N2O2
Molecular Weight	154.1665
SMILES	O=C(C1=CC(C)=NN1C)OC
Synonyms	methyl 1,3-dimethyl-1H-pyrazole-5-carboxylate, 10250-59-6, 1H-Pyrazole-5-carboxylic acid, 1,3-dimethyl-, methyl ester, SCHEMBL975064, KS-00000RIL, DTXSID50480979, KYQGPXFQWUSRMY-UHFFFAOYSA-N, BBL030468, MFCD06204177, STK351151, ZINC12394938, AKOS005167438, DS-4459, MCULE-9752403963, AJ-62035, AK133239, methyl 1,3-dimethylpyrazole-5-carboxylate, CS-0054564, ST45115733, W9909, K-0309, Methyl 2,5-dimethyl-2H-pyrazole-3-carboxylate, 1,3-Dimethyl-1H-pyrazole-5-carboxylic acid methyl ester, 2,5-dimethyl-2H-pyrazole-3-carboxylic acid methyl ester, C7H10N2O2, Methyl1,3-dimethyl-1H-pyrazole-5-carboxylate,

Complexity	161
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	154.074g/mol
Formal Charge	0
Heavy Atom Count	11
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	154.169g/mol
Monoisotopic Mass	154.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	44.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.8

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	3
Hazard statements	H302
Packing Group	Ⅲ
Precautionary statements	P280-P305+P351+P338
UN Code	UN 1993

Certificate of Analysis

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