| CAS Number | 147992-28-7 |
| Catalog Number | AG019W7L(AGN-PC-0034D9) |
| Chemical Name | 4-(Difluoromethoxy)benzamide |
| IUPAC Name | 4-(difluoromethoxy)benzamide |
| InChI | InChI=1S/C8H7F2NO2/c9-8(10)13-6-3-1-5(2-4-6)7(11)12/h1-4,8H,(H2,11,12) |
| InChI Key | HCQDUYGHJUQQAD-UHFFFAOYSA-N |
| MDL Number | MFCD11643210 |
| Molecular Formula | C8H7F2NO2 |
| Molecular Weight | 187.1435 |
| SMILES | NC(C1=CC=C(OC(F)F)C=C1)=O |
| Synonyms | 4-(difluoromethoxy)benzamide,
147992-28-7,
AC1Q4ZE1,
SCHEMBL2762402,
CTK7B7308,
STL301713,
ZINC34412715,
AKOS008937905,
MCULE-9899817458,
NE28875,
EN300-50964,
Z33546844,
|
| Complexity | 179 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.044g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.146g/mol |
| Monoisotopic Mass | 187.044g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 52.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number