AG000ILQ

118264-04-3 | 6-Phenylazaperhydroine-2,4-dione

AG000ILQ

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CAS Number	118264-04-3
Catalog Number	AG000ILQ(AGN-PC-00F3PN)
Chemical Name	6-Phenylazaperhydroine-2,4-dione
IUPAC Name	6-phenylpiperidine-2,4-dione
InChI	InChI=1S/C11H11NO2/c13-9-6-10(12-11(14)7-9)8-4-2-1-3-5-8/h1-5,10H,6-7H2,(H,12,14)
InChI Key	IBYLHJWZATWPEB-UHFFFAOYSA-N
MDL Number	MFCD10568157
Molecular Formula	C11H11NO2
Molecular Weight	189.2105
SMILES	O=C(C1)NC(C2=CC=CC=C2)CC1=O
Synonyms	6-phenylpiperidine-2,4-dione, 118264-04-3, 6-Phenylazaperhydroine-2,4-dione, 2,4-Piperidinedione, 6-phenyl-, 6-phenyl-2,4-Piperidinedione, SCHEMBL9711479, KS-00000DOO, IBYLHJWZATWPEB-UHFFFAOYSA-N, 6459AJ, MFCD10568157, AKOS006228892, TRA0089376, AS-31603, SC-25085, SY002494, DB-018684, FT-0692927, K-1275, MFCD10568157 (97+%), 6-phenyl-5,6-dihydro-2,4(1H,3H)-pyridinedione, I14-34278, 326477-54-7, C11H11NO2, CID11171474,

Complexity	244
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	189.079g/mol
Formal Charge	0
Heavy Atom Count	14
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
Isotope Atom Count	0
Molecular Weight	189.214g/mol
Monoisotopic Mass	189.079g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	46.2A^2
Undefined Atom Stereocenter Count	1
Undefined Bond Stereocenter Count	0
XLogP3	0.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class
Hazard statements	H302-H315-H319
Packing Group
Precautionary statements	P261-P305+P351+P338
UN Code

Certificate of Analysis

Lot Number