| CAS Number | 86386-67-6 |
| Catalog Number | AG008GGN(AGN-PC-0NGVAE) |
| Chemical Name | N-(4-Chlorobenzyl)formamide |
| IUPAC Name | N-[(4-chlorophenyl)methyl]formamide |
| InChI | InChI=1S/C8H8ClNO/c9-8-3-1-7(2-4-8)5-10-6-11/h1-4,6H,5H2,(H,10,11) |
| InChI Key | YDLAQBRNNOLMIH-UHFFFAOYSA-N |
| MDL Number | MFCD16620259 |
| Molecular Formula | C8H8ClNO |
| Molecular Weight | 169.6082 |
| SMILES | O=CNCc1ccc(cc1)Cl |
| Synonyms | N-(4-chlorobenzyl)formamide,
86386-67-6,
Formamide, N-[(4-chlorophenyl)methyl]-,
4-chlorobenzylcarbamoyl,
4-chlorobenzyl-formamide,
SCHEMBL349260,
CTK3C7326,
DTXSID30457184,
MFCD16620259,
ZINC38312324,
AKOS014313266,
N-[(4-chlorophenyl)methyl]formamide,
CID11159563,
|
| Complexity | 121 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 169.029g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 11 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 169.608g/mol |
| Monoisotopic Mass | 169.029g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
| Symbol: | |
|
Hazard statements
|
|
|
Precautionary statements
|
|
Certificate of Analysis
Lot Number