| CAS Number | 207989-90-0 |
| Catalog Number | AG002JEQ(AGN-PC-0MV06U) |
| Chemical Name | 2-Pyrrolidinone, 5-(4-bromophenyl)- |
| IUPAC Name | 5-(4-bromophenyl)pyrrolidin-2-one |
| InChI | InChI=1S/C10H10BrNO/c11-8-3-1-7(2-4-8)9-5-6-10(13)12-9/h1-4,9H,5-6H2,(H,12,13) |
| InChI Key | PFJCJXIUAVSTJB-UHFFFAOYSA-N |
| MDL Number | MFCD15527558 |
| Molecular Formula | C10H10BrNO |
| Molecular Weight | 240.0965 |
| SMILES | BrC1=CC=C(C=C1)C1CCC(=O)N1 |
| Synonyms | 5-(4-BROMOPHENYL)PYRROLIDIN-2-ONE,
207989-90-0,
2-Pyrrolidinone, 5-(4-bromophenyl)-,
SCHEMBL482061,
CTK8C0670,
DTXSID50476599,
PFJCJXIUAVSTJB-UHFFFAOYSA-N,
5-(4-bromophenyl)-2-pyrrolidinone,
0640AB,
ANW-65067,
MFCD15527558,
5-(4-bromophenyl)-pyrrolidin-2-one,
AKOS016005170,
gamma-4-bromophenyl-gamma-butyrolactam,
DS-4027,
AK103149,
(5R)-5-(4-bromophenyl)pyrrolidin-2-one,
TC-153812,
Z2756332611,
C10H10BrNO,
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| Complexity | 199 |
| 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 | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 240.1g/mol |
| Monoisotopic Mass | 238.995g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
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Certificate of Analysis
Lot Number