AG00EAEF

60484-29-9 | 5-Hydroxy-3-methyl-1-phenylpyrazole-4-carbaldehyde

AG00EAEF

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CAS Number	60484-29-9
Catalog Number	AG00EAEF(AGN-PC-0OD49U)
Chemical Name	5-Hydroxy-3-methyl-1-phenylpyrazole-4-carbaldehyde
IUPAC Name	5-methyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde
InChI	InChI=1S/C11H10N2O2/c1-8-10(7-14)11(15)13(12-8)9-5-3-2-4-6-9/h2-7,12H,1H3
InChI Key	RWBBDSAYSNJJHM-UHFFFAOYSA-N
MDL Number	MFCD00448479
Molecular Formula	C11H10N2O2
Molecular Weight	202.2093
SMILES	N1(C2=CC=CC=C2)N=C(C(C=O)=C1O)C
Synonyms	5-hydroxy-3-methyl-1-phenyl-1H-pyrazole-4-carbaldehyde, 60484-29-9, 5-hydroxy-3-methyl-1-phenylpyrazole-4-carbaldehyde, AKOS BBS-00003106, 1H-Pyrazole-4-carboxaldehyde, 5-hydroxy-3-methyl-1-phenyl-, 5-methyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde, 4702-79-8, ZERO/003370, CBMicro_027636, AC1LEL22, Cambridge id 5677040, SCHEMBL435880, 5-methyl-3-oxo-2-phenyl-1H-pyrazole-4-carbaldehyde, SCHEMBL8883561, SCHEMBL13678890, SCHEMBL14518012, CTK1D1837, CTK2F0292, CTK7H7956, CAABWYILLVOLJI-UHFFFAOYSA-N, RWBBDSAYSNJJHM-UHFFFAOYSA-N, ALBB-010206, ZINC5497756, 6540AE, BBL003457, MFCD00448479, SBB002325, STK009191, STK681096, STL024023, AKOS000268614, AKOS002343169, AKOS005596334, AKOS030544859, ZINC100142516, ZINC100708979, ZINC101449665, MCULE-1986366355, 3-methyl-1-phenyl-4-formylpyrazol-5-one, AJ-54210, AJ-54211, ST057481, BIM-0027807.P001, AB0158314, FT-0684337, 1-phenyl-3-methyl-4-formyl-5-hydroxypyrazole, W-8863, AB00093076-01, AJ-077/33273027, SR-01000216735, SR-01000216735-1, 3-methyl-5-oxo-1-phenyl-2H-pyrazole-4-carbaldehyde, 3-methyl-5-oxo-1-phenyl-3-pyrazoline-4-carbaldehyde, I14-30825, 1-Phenyl-3-methyl-5-hydroxy-1H-pyrazole-4-carbaldehyde, 1H-Pyrazole-4-carbaldehyde, 5-hydroxy-3-methyl-1-phenyl-, 2,3-Dihydro-4-formyl-5-methyl-3-oxo-2-phenyl-1H-pyrazole, 2,3-Dihydro-5-methyl-3-oxo-2-phenyl-1H-pyrazole-4-carboxaldehyde, 1H-Pyrazole-4-carboxaldehyde, 2,5-dihydro-3-methyl-5-oxo-1-phenyl-, 3H-Pyrazol-3-one, 2,4-dihydro-4-(hydroxymethylene)-5-methyl-2-phenyl-, (4Z)-4-(hydroxymethylidene)-5-methyl-2-phenyl-2,4-dihydro-3H-pyrazol-3-one, C11H10N2O2, AKOSBBS-00003106, CID687977,

Complexity	317
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	202.074g/mol
Formal Charge	0
Heavy Atom Count	15
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	202.213g/mol
Monoisotopic Mass	202.074g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	49.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

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