| CAS Number | 69131-52-8 |
| Catalog Number | AG019MVF(AGN-PC-0WNLB5) |
| Chemical Name | 1-(3-Amino-4-Chlorophenyl)Pyrrolidin-2-One |
| IUPAC Name | 1-(3-amino-4-chlorophenyl)pyrrolidin-2-one |
| InChI | InChI=1S/C10H11ClN2O/c11-8-4-3-7(6-9(8)12)13-5-1-2-10(13)14/h3-4,6H,1-2,5,12H2 |
| InChI Key | HBHRGBJNYKUBGG-UHFFFAOYSA-N |
| MDL Number | MFCD09043229 |
| Molecular Formula | C10H11ClN2O |
| Molecular Weight | 210.6601 |
| SMILES | C1CC(=O)N(C1)C2=CC(=C(C=C2)Cl)N |
| Synonyms | 1-(3-amino-4-chlorophenyl)pyrrolidin-2-one,
1-(3-AMINO-4-CHLORO-PHENYL)-PYRROLIDIN-2-ONE,
69131-52-8,
AC1Q50ZM,
SCHEMBL6028503,
CTK7H4081,
HBHRGBJNYKUBGG-UHFFFAOYSA-N,
4039AH,
SBB085440,
ZINC21948252,
AKOS000127610,
MCULE-7269001526,
NE14148,
TR-056979,
2-chloro-5-(2-oxo-pyrrolidin-1-yl)aniline,
EN300-37409,
AB00995188-01,
C10H11ClN2O,
|
| Complexity | 234 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 210.056g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 210.661g/mol |
| Monoisotopic Mass | 210.056g/mol |
| Rotatable Bond Count | 1 |
| Topological Polar Surface Area | 46.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number