| CAS Number | 851903-50-9 |
| Catalog Number | AG019NYB(AGN-PC-0LK8OM) |
| Chemical Name | 2-chloro-N-{[4-(difluoromethoxy)phenyl]methyl}-N-methylacetamide |
| IUPAC Name | 2-chloro-N-[[4-(difluoromethoxy)phenyl]methyl]-N-methylacetamide |
| InChI | InChI=1S/C11H12ClF2NO2/c1-15(10(16)6-12)7-8-2-4-9(5-3-8)17-11(13)14/h2-5,11H,6-7H2,1H3 |
| InChI Key | FZYXNGLTRRALIC-UHFFFAOYSA-N |
| MDL Number | MFCD06655257 |
| Molecular Formula | C11H12ClF2NO2 |
| Molecular Weight | 263.6683 |
| SMILES | CN(C(CCl)=O)CC1=CC=C(OC(F)F)C=C1 |
| Synonyms | 2-chloro-N-{[4-(difluoromethoxy)phenyl]methyl}-N-methylacetamide,
851903-50-9,
2-chloro-N-[4-(difluoromethoxy)benzyl]-N-methylacetamide,
2-chloro-N-[[4-(difluoromethoxy)phenyl]methyl]-N-methylacetamide,
AC1NLPO6,
AC1Q3XCE,
CTK6H4895,
ZINC4205080,
AKOS000118227,
MCULE-9734941653,
NE23382,
EN300-12145,
ZINC04205080,
CID4961808,
Acetamide, 2-chloro-N-[[4-(difluoromethoxy)phenyl]methyl]-N-methyl,
|
| Complexity | 246 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 263.052g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 263.669g/mol |
| Monoisotopic Mass | 263.052g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number