AG0036BD

876-93-7 | 1-Phenyl-1H-pyrazol-5-ol

AG0036BD

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CAS Number	876-93-7
Catalog Number	AG0036BD(AGN-PC-0OL7G7)
Chemical Name	1-Phenyl-1H-pyrazol-5-ol
IUPAC Name	2-phenyl-1H-pyrazol-3-one
InChI	InChI=1S/C9H8N2O/c12-9-6-7-10-11(9)8-4-2-1-3-5-8/h1-7,10H
InChI Key	ILPGQKHPPSSCBS-UHFFFAOYSA-N
MDL Number	MFCD00462229
Molecular Formula	C9H8N2O
Molecular Weight	160.1726
SMILES	C1(=CC=CC=C1)N1N=CC=C1O
Synonyms	1-phenyl-1H-pyrazol-5-ol, 876-93-7, 2-phenyl-1H-pyrazol-3(2H)-one, 7456-81-7, 2-phenyl-1H-pyrazol-3-one, 1,2-Dihydro-2-phenyl-3H-pyrazol-3-one, 1-phenyl-pyrazol-5-one, 1-phenylpyrazol-5-ol, AC1MCOPP, 1-phenylpyrazol-5-one, 1-phenyl-5-hydroxypyrazole, 1-Phenyl-1H-pyrazole-5-ol, 1-phenyl-3-pyrazolin-5-one, SCHEMBL1232067, SCHEMBL5579308, 1H-Pyrazol-5-ol, 1-phenyl-, CTK2G9986, CTK2I2200, KS-00000PFM, ILPGQKHPPSSCBS-UHFFFAOYSA-N, ZINC5519478, MFCD00462229, STK328127, AKOS003726171, AKOS022172045, ZINC100003571, ACN-000993, ACN-000994, DS-6772, MCULE-9652617538, NE54821, 2-Phenyl-1,2-dihydro-3H-pyrazol-3-one, AJ-54252, AK139794, DA-16767, 3H-Pyrazol-3-one, 1,2-dihydro-2-phenyl-, FT-0727129, ST45171338, ZINC02565668, CID2748710,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	160.064g/mol
Formal Charge	0
Heavy Atom Count	12
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	160.176g/mol
Monoisotopic Mass	160.064g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	32.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	1.5

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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