| CAS Number | 40023-27-6 |
| Catalog Number | AG019KSX |
| Chemical Name | 2-chloro-N-[1-(4-chlorophenyl)propyl]acetamide |
| IUPAC Name | 2-chloro-N-[1-(4-chlorophenyl)propyl]acetamide |
| InChI | InChI=1S/C11H13Cl2NO/c1-2-10(14-11(15)7-12)8-3-5-9(13)6-4-8/h3-6,10H,2,7H2,1H3,(H,14,15) |
| InChI Key | WDGQEEFEABQVJJ-UHFFFAOYSA-N |
| MDL Number | MFCD09971336 |
| Molecular Formula | C11H13Cl2NO |
| Molecular Weight | 246.1330 |
| SMILES | CCC(C1=CC=C(Cl)C=C1)NC(CCl)=O |
| Synonyms | 2-chloro-N-[1-(4-chlorophenyl)propyl]acetamide,
40023-27-6,
AC1Q2SJV,
CTK6C8093,
AKOS008099183,
MCULE-9517975383,
NE20570,
EN300-28303,
|
| Complexity | 203 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 245.037g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 246.131g/mol |
| Monoisotopic Mass | 245.037g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.2 |
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Certificate of Analysis
Lot Number