| CAS Number | 1078163-22-0 |
| Catalog Number | AG019MCH |
| Chemical Name | N-(3,5-Dichlorophenyl)pyrrolidine-2-carboxamide hydrochloride |
| IUPAC Name | N-(3,5-dichlorophenyl)pyrrolidine-2-carboxamide;hydrochloride |
| InChI | InChI=1S/C11H12Cl2N2O.ClH/c12-7-4-8(13)6-9(5-7)15-11(16)10-2-1-3-14-10;/h4-6,10,14H,1-3H2,(H,15,16);1H |
| InChI Key | YDYPNOVMNGLJGD-UHFFFAOYSA-N |
| MDL Number | MFCD10686758 |
| Molecular Formula | C11H13Cl3N2O |
| Molecular Weight | 295.5927 |
| SMILES | Cl.ClC1=CC(NC(C2NCCC2)=O)=CC(Cl)=C1 |
| Synonyms | N-(3,5-dichlorophenyl)pyrrolidine-2-carboxamide hydrochloride,
1078163-22-0,
AC1Q3B8W,
CTK7F9270,
AKOS016899290,
MCULE-6439225228,
NE33746,
EN300-35763,
Z367451134,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 294.009g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 295.588g/mol |
| Monoisotopic Mass | 294.009g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 41.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number