AG003KNH

22198-72-7 | 4-Aminoantipyrine HCl

AG003KNH

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CAS Number	22198-72-7
Catalog Number	AG003KNH(AGN-PC-0JLAPV)
Chemical Name	4-Aminoantipyrine HCl
EC Number	244-832-4
IUPAC Name	4-amino-1,5-dimethyl-2-phenylpyrazol-3-one;hydrochloride
InChI	InChI=1S/C11H13N3O.ClH/c1-8-10(12)11(15)14(13(8)2)9-6-4-3-5-7-9;/h3-7H,12H2,1-2H3;1H
InChI Key	UZSCVCWALGRUTR-UHFFFAOYSA-N
MDL Number	MFCD00042012
Molecular Formula	C11H14ClN3O
Molecular Weight	239.7014
NSC Number	1740
SMILES	Cl.CN1N(C(=O)C(N)=C1C)C1=CC=CC=C1
UNII	F7WGH82I6D
Synonyms	22198-72-7, 4-Aminoantipyrine hydrochloride, 4-Amino-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-one hydrochloride, UNII-F7WGH82I6D, 4-AMINOANTIPYRINE HCl, F7WGH82I6D, 3H-Pyrazol-3-one, 4-amino-1,2-dihydro-1,5-dimethyl-2-phenyl-, monohydrochloride, 3H-Pyrazol-3-one, 4-amino-1,2-dihydro-1,5-dimethyl-2-phenyl-, hydrochloride (1:1), NSC1740, NSC 1740, EINECS 244-832-4, Ampyrone hydrochloride, Antipyrine, 4-amino-, monohydrochloride, AC1L2IEB, AC1Q3EMU, 4-AA.HCl, aminoantipyrine hydrochloride, Antipyrine, monohydrochloride, SCHEMBL1830291, DTXSID8066769, CTK8B7655, NSC-1740, ANW-58083, MFCD00042012, SBB073000, 4-Amino-1,2-dihydro-1,5-dimethyl-2-phenyl-3H-pyrazol-3-one monohydrochloride, AKOS015902338, MCULE-9008104224, VZ28288, ACM22198727, KS-0000129E, AK-89298, CC-17876, AX8013172, TR-030861, A0257, FT-0638196, ST24028864, ST45255268, C-14327, 4-AminoantipyrineHydrochloride[forBiochemicalResearch], I14-13527, 4-amino-1,5-dimethyl-2-phenylpyrazol-3-one hydrochloride, 3H-Pyrazol-3-one,2-dihydro-1,5-dimethyl-2-phenyl-, monohydrochloride, 3H-Pyrazol-3-one,4-amino-1,2-dihydro-1,5-dimethyl-2-phenyl-, hydrochloride (1:1), C11H14ClN3O, C11H13N3O.ClH, C11-H13-N3-O.Cl-H, CID72639, AR-1G0763, L627, 4-Amino-1,5-dimethyl-2-phenyl-1H-pyrazol-3(2H)-onehydrochloride, 22753-81-7,

Complexity	305
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	239.083g/mol
Formal Charge	0
Heavy Atom Count	16
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	239.703g/mol
Monoisotopic Mass	239.083g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	49.6A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P264-P270-P280-P301+P312+P330-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313-P501
UN Code

Certificate of Analysis

Lot Number