| CAS Number | 851879-22-6 |
| Catalog Number | AG019NYC |
| Chemical Name | 2-Chloro-N-(2-chloro-6-fluorobenzyl)-N-methylacetamide |
| IUPAC Name | 2-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide |
| InChI | InChI=1S/C10H10Cl2FNO/c1-14(10(15)5-11)6-7-8(12)3-2-4-9(7)13/h2-4H,5-6H2,1H3 |
| InChI Key | DOEZIAVDDBCIOS-UHFFFAOYSA-N |
| MDL Number | MFCD06655258 |
| Molecular Formula | C10H10Cl2FNO |
| Molecular Weight | 250.0969 |
| SMILES | CN(CC1=C(C=CC=C1F)Cl)C(=O)CCl |
| Synonyms | 2-chloro-N-(2-chloro-6-fluorobenzyl)-N-methylacetamide,
851879-22-6,
2-chloro-N-[(2-chloro-6-fluorophenyl)methyl]-N-methylacetamide,
AC1M7YC4,
AC1Q3XB7,
CTK6H4881,
ZINC3407860,
SBB016560,
AKOS000123061,
MCULE-8259037146,
NE13349,
ST50329611,
EN300-12146,
SR-01000064749,
J-509053,
SR-01000064749-1,
ZINC03407860,
CID2526704,
2-Chloro-n-(2-chloro-6-fluoro-benzyl)-n-methylacetamide,
|
| Complexity | 228 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 249.012g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 250.094g/mol |
| Monoisotopic Mass | 249.012g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 20.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number