AG003K25

223786-04-7 | Piperazinone, 4-(4-aminophenyl)- (9CI)

AG003K25

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CAS Number	223786-04-7
Catalog Number	AG003K25(AGN-PC-015V0P)
Chemical Name	Piperazinone, 4-(4-aminophenyl)- (9CI)
IUPAC Name	4-(4-aminophenyl)piperazin-2-one
InChI	InChI=1S/C10H13N3O/c11-8-1-3-9(4-2-8)13-6-5-12-10(14)7-13/h1-4H,5-7,11H2,(H,12,14)
InChI Key	PZAWODZZVTUFBG-UHFFFAOYSA-N
MDL Number	MFCD09047703
Molecular Formula	C10H13N3O
Molecular Weight	191.2297
SMILES	O=C1NCCN(C2=CC=C(N)C=C2)C1
Synonyms	223786-04-7, 4-(4-Aminophenyl)-2-piperazinone, 4-(4-aminophenyl)piperazin-2-one, Piperazinone, 4-(4-aminophenyl)-, Piperazinone, 4-(4-aminophenyl)- (9CI), AC1Q51W9, SCHEMBL3125646, CTK4E9339, DTXSID00588292, 2-Piperazinone,4-(4-aminophenyl)-, 7660AD, MFCD09047703, ZINC17156051, AKOS000131556, MCULE-8582174098, RTR-010543, TRA0069962, KS-000009V3, AJ-69984, AS-31735, CJ-15746, SY015752, AB0063977, DB-024175, TR-010543, BB 0256854, FT-0681377, EN300-37211, K-6308, MFCD09047703 (97+%), I13-538, F2158-0211, Piperazinone,4- -, C10H13N3O, 144025-03-6,

Complexity	211
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	191.106g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
Isotope Atom Count	0
Molecular Weight	191.234g/mol
Monoisotopic Mass	191.106g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	58.4A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	0.5

GHS Hazard and Precautionary Statements

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

Certificate of Analysis

Lot Number