| CAS Number | 875157-00-9 |
| Catalog Number | AG019PDD |
| Chemical Name | 2-chloro-N-{2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl}acetamide |
| IUPAC Name | 2-chloro-N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]acetamide |
| InChI | InChI=1S/C12H14ClF2NO3/c1-18-10-6-8(4-5-16-11(17)7-13)2-3-9(10)19-12(14)15/h2-3,6,12H,4-5,7H2,1H3,(H,16,17) |
| InChI Key | NTRZLLZMJSGTHI-UHFFFAOYSA-N |
| MDL Number | MFCD07838316 |
| Molecular Formula | C12H14ClF2NO3 |
| Molecular Weight | 293.6943 |
| SMILES | COC1=C(OC(F)F)C=CC(CCNC(CCl)=O)=C1 |
| Synonyms | 2-chloro-N-{2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl}acetamide,
875157-00-9,
2-chloro-N-[2-[4-(difluoromethoxy)-3-methoxyphenyl]ethyl]acetamide,
AC1OFMCU,
AC1Q46DR,
CTK6H5911,
ZINC4219131,
AKOS009075617,
MCULE-3388572384,
NE26163,
UPCMLD0ENAT5488292:001,
EN300-23282,
ZINC04219131,
CID7131835,
|
| Complexity | 282 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 293.063g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 19 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 293.695g/mol |
| Monoisotopic Mass | 293.063g/mol |
| Rotatable Bond Count | 7 |
| Topological Polar Surface Area | 47.6A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.6 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number