| CAS Number | 872046-13-4 |
| Catalog Number | AG01A2FZ |
| Chemical Name | 4-(Difluoromethoxy)benzeneethanol |
| IUPAC Name | 2-[4-(difluoromethoxy)phenyl]ethanol |
| InChI | InChI=1S/C9H10F2O2/c10-9(11)13-8-3-1-7(2-4-8)5-6-12/h1-4,9,12H,5-6H2 |
| InChI Key | QHCZMLWSRRFIBK-UHFFFAOYSA-N |
| MDL Number | MFCD09926279 |
| Molecular Formula | C9H10F2O2 |
| Molecular Weight | 188.1713 |
| SMILES | FC(F)OC1=CC=C(C=C1)CCO |
| Synonyms | 2-[4-(difluoromethoxy)phenyl]ethan-1-ol,
872046-13-4,
Benzeneethanol, 4-(difluoromethoxy)-,
SCHEMBL3117530,
QHCZMLWSRRFIBK-UHFFFAOYSA-N,
2-(4-Difluoromethoxyphenyl)-ethanol,
ZINC44379995,
AKOS006310969,
NE46294,
|
| Complexity | 134 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 188.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 13 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 188.174g/mol |
| Monoisotopic Mass | 188.065g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number