| CAS Number | 101167-55-9 |
| Catalog Number | AG019K7G |
| Chemical Name | 3-chloro-N-(diphenylmethyl)propanamide |
| IUPAC Name | N-benzhydryl-3-chloropropanamide |
| InChI | InChI=1S/C16H16ClNO/c17-12-11-15(19)18-16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,16H,11-12H2,(H,18,19) |
| InChI Key | BMSOFUFZCCLRFJ-UHFFFAOYSA-N |
| MDL Number | MFCD02973946 |
| Molecular Formula | C16H16ClNO |
| Molecular Weight | 273.7573 |
| SMILES | ClCCC(NC(C1=CC=CC=C1)C1=CC=CC=C1)=O |
| Synonyms | 3-chloro-N-(diphenylmethyl)propanamide,
101167-55-9,
N-benzhydryl-3-chloropropanamide,
AC1MUTO8,
AC1Q3UF7,
CTK6H7279,
ZINC5871698,
AKOS001425612,
MCULE-1804096599,
NE19977,
UPCMLD0ENAT5948494:001,
EN300-25838,
N-benzhydryl-3-chloro-propanamide,
3-chloro-propionic acid benzhydrylamide,
CID3646448,
|
| Complexity | 252 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 273.092g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 273.76g/mol |
| Monoisotopic Mass | 273.092g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number