AG00414I

89-29-2 | Benzenesulfonamide,3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-

AG00414I

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CAS Number	89-29-2
Catalog Number	AG00414I(AGN-PC-0JL7AF)
Chemical Name	Benzenesulfonamide,3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-
EC Number	201-895-2
IUPAC Name	3-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide
InChI	InChI=1S/C10H11N3O3S/c1-7-5-10(14)13(12-7)8-3-2-4-9(6-8)17(11,15)16/h2-4,6H,5H2,1H3,(H2,11,15,16)
InChI Key	ASVVGQURNHNITH-UHFFFAOYSA-N
MDL Number	MFCD00035707
Molecular Formula	C10H11N3O3S
Molecular Weight	253.2776
NSC Number	15355
SMILES	CC1=NN(C(=O)C1)c1cccc(c1)S(N)(=O)=O
Synonyms	89-29-2, 3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone, 3-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonamide, Benzenesulfonamide, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, CHEMBL2392434, W-100379, 3-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonamide, Benzenesulfonamide, m-(3-methyl-5-oxo-2-pyrazolin-1-yl)-, Benzenesulfonamide,3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, ASVVGQURNHNITH-UHFFFAOYSA-N, NSC15355, EINECS 201-895-2, NSC 15355, AC1Q6UKH, Maybridge1_006372, CBDivE_007658, AC1L25T5, SCHEMBL4108427, DTXSID0058984, CTK5G2810, HMS559J14, KS-000015DS, BDBM50004951, CCG-46066, m-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonamide, MFCD00035707, NSC-15355, AKOS000560184, ZINC100044408, MCULE-3650687763, AN-42460, BAS 00328923, RH 01325, FT-0629009, M0659, AE-641/00786007, SR-01000635789-1, 3-Methyl-1-(3'-sulfoamidophenyl)-5-pyrazolone, 97%, 1-[3-(Aminosulfonyl)phenyl]-3-methyl-5(4H)-pyrazolone, Benzenesulfonamide,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, 3-(3-Methyl-5-oxo-4,5-dihydro-pyrazol-1-yl)-benzenesulfonamide, 3-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonamide, 3-(4,5-Dihydro-3-Methyl-5-Oxo-1H-Pyrazol-1YL)-Benzenesulfonamide, Benzenesulfonamide, m-(3-methyl-5-oxo-2-pyrazolin-1-yl)- (8CI), 3-(3-Methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl)benzenesulfonamide #, 3-Methyl-1-(3 inverted exclamation marka-sulfoamidophenyl)-5-pyrazolone, C10H11N3O3S, CID66634, AR-1E6650, C10-H11-N3-O3-S, 3-Methyl-1-(3'-sulfamoylphenyl)-5-pyrazolone, A10701, 3-(3-methyl-5-oxo-2,5-dihydro-1H-pyrazol-1-yl)benzenesulfonamide, 3-(3-methyl-5-oxo-2H-pyrazol-1(5H)-yl)benzenesulfonamide, m-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzensulfonamid, 94849-86-2,

Complexity	452
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	253.052g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	253.276g/mol
Monoisotopic Mass	253.052g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	101A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	-0.2

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H315-H319
Packing Group
Precautionary statements	P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
UN Code

Certificate of Analysis

Lot Number