| CAS Number | 923207-68-5 |
| Catalog Number | AG00GUDQ |
| Chemical Name | 3-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide |
| IUPAC Name | 3-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide |
| InChI | InChI=1S/C13H15ClN2O2/c14-8-7-12(17)15-10-3-5-11(6-4-10)16-9-1-2-13(16)18/h3-6H,1-2,7-9H2,(H,15,17) |
| InChI Key | XZUBHHHZKAVOTM-UHFFFAOYSA-N |
| MDL Number | MFCD08444133 |
| Molecular Formula | C13H15ClN2O2 |
| Molecular Weight | 266.7234 |
| SMILES | O=C(NC1=CC=C(N2C(CCC2)=O)C=C1)CCCl |
| Synonyms | 3-chloro-N-[4-(2-oxopyrrolidin-1-yl)phenyl]propanamide,
923207-68-5,
3-Chloro-N-(4-(2-oxopyrrolidin-1-yl)phenyl)propanamide,
AC1Q3UFZ,
CTK6H7322,
ZINC8269640,
AKOS001274482,
MCULE-6887667263,
NE27267,
EN300-23124,
J-512322,
Z208331628,
3-Chloro-n-[4-(2-Oxo-pyrrolidin-1-yl)phenyl]propanamide,
ZINC08269640,
CID9397920,
572882-25-8,
|
| Complexity | 314 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 266.082g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 266.725g/mol |
| Monoisotopic Mass | 266.082g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number