AG00C0YX

38348-83-3 | 1-(3-Bromophenyl)pyrrolidin-2-one

AG00C0YX

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CAS Number	38348-83-3
Catalog Number	AG00C0YX(AGN-PC-0JXSX8)
Chemical Name	1-(3-Bromophenyl)pyrrolidin-2-one
IUPAC Name	1-(3-bromophenyl)pyrrolidin-2-one
InChI	InChI=1S/C10H10BrNO/c11-8-3-1-4-9(7-8)12-6-2-5-10(12)13/h1,3-4,7H,2,5-6H2
InChI Key	QKSLLUAHJIQQGI-UHFFFAOYSA-N
MDL Number	MFCD00624876
Molecular Formula	C10H10BrNO
Molecular Weight	240.0965
SMILES	O=C1N(C2=CC=CC(Br)=C2)CCC1
Synonyms	1-(3-bromophenyl)pyrrolidin-2-one, 38348-83-3, SMR000114429, ACMC-209izl, AC1LI7FA, AC1Q24JP, MLS000549442, SCHEMBL1634757, CHEMBL2131428, CTK4H9813, DTXSID80358475, QKSLLUAHJIQQGI-UHFFFAOYSA-N, HMS2379H22, ZINC477959, 1-(3-bromophenyl)-2-pyrrolidinone, 1-(3-Bromophenyl)pyrrolidine-2-one, ANW-28879, MFCD00624876, AKOS000175979, 1-(3-Bromo-phenyl)-pyrrolidin-2-one, 2-Pyrrolidinone, 1-(3-bromophenyl)-, MCULE-8540881132, AJ-23084, TR-036659, V5632, EN300-40376, B-3664, I11-673, Z55670892, C10H10BrNO, CID899668,

Complexity	207
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	238.995g/mol
Formal Charge	0
Heavy Atom Count	13
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	240.1g/mol
Monoisotopic Mass	238.995g/mol
Rotatable Bond Count	1
Topological Polar Surface Area	20.3A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	2

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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