| CAS Number | 749906-90-9 |
| Catalog Number | AG019JD9 |
| Chemical Name | 2-chloro-N-[1-(2,4-dichlorophenyl)ethyl]propanamide |
| IUPAC Name | 2-chloro-N-[1-(2,4-dichlorophenyl)ethyl]propanamide |
| InChI | InChI=1S/C11H12Cl3NO/c1-6(12)11(16)15-7(2)9-4-3-8(13)5-10(9)14/h3-7H,1-2H3,(H,15,16) |
| InChI Key | LGSHJXQUNJYFNJ-UHFFFAOYSA-N |
| MDL Number | MFCD06336098 |
| Molecular Formula | C11H12Cl3NO |
| Molecular Weight | 280.5781 |
| SMILES | CC(C(NC(C1=C(Cl)C=C(Cl)C=C1)C)=O)Cl |
| Synonyms | 2-chloro-N-[1-(2,4-dichlorophenyl)ethyl]propanamide,
749906-90-9,
AC1MZ1RQ,
AC1Q2AUH,
CTK7F4272,
AKOS000117671,
AKOS017268190,
MCULE-7565949327,
NE18479,
EN300-09146,
ZINC02654600,
CID3841046,
|
| Complexity | 249 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 278.998g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 280.573g/mol |
| Monoisotopic Mass | 278.998g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number