| CAS Number | 923163-06-8 |
| Catalog Number | AG019PE6 |
| Chemical Name | 2-Chloro-n-(2-chlorobenzyl)propanamide |
| IUPAC Name | 2-chloro-N-[(2-chlorophenyl)methyl]propanamide |
| InChI | InChI=1S/C10H11Cl2NO/c1-7(11)10(14)13-6-8-4-2-3-5-9(8)12/h2-5,7H,6H2,1H3,(H,13,14) |
| InChI Key | BTVPJHXOTDGWSV-UHFFFAOYSA-N |
| MDL Number | MFCD08444162 |
| Molecular Formula | C10H11Cl2NO |
| Molecular Weight | 232.1064 |
| SMILES | CC(C(NCC1=C(Cl)C=CC=C1)=O)Cl |
| Synonyms | 2-chloro-N-(2-chlorobenzyl)propanamide,
2-chloro-N-[(2-chlorophenyl)methyl]propanamide,
923163-06-8,
AC1Q2AYK,
CTK7F4375,
AKOS000198918,
AKOS016893283,
MCULE-4916787624,
NE20886,
EN300-23342,
|
| Complexity | 199 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 231.022g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 1 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 232.104g/mol |
| Monoisotopic Mass | 231.022g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 29.1A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.7 |
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Certificate of Analysis
Lot Number