| CAS Number | 929341-33-3 |
| Catalog Number | AG019MFH |
| Chemical Name | 1-[2-(difluoromethoxy)phenyl]propan-1-one |
| IUPAC Name | 1-[2-(difluoromethoxy)phenyl]propan-1-one |
| InChI | InChI=1S/C10H10F2O2/c1-2-8(13)7-5-3-4-6-9(7)14-10(11)12/h3-6,10H,2H2,1H3 |
| InChI Key | GJDKFXPSSMGLKD-UHFFFAOYSA-N |
| MDL Number | MFCD09259620 |
| Molecular Formula | C10H10F2O2 |
| Molecular Weight | 200.1820 |
| SMILES | CCC(C1=C(OC(F)F)C=CC=C1)=O |
| Synonyms | 1-[2-(difluoromethoxy)phenyl]propan-1-one,
929341-33-3,
1-(2-(Difluoromethoxy)phenyl)propan-1-one,
AC1Q2RMF,
SCHEMBL19388312,
CTK6C6561,
ZINC20283176,
NE14234,
EN300-36023,
2'-(Difluoromethoxy)propiophenone,
|
| Complexity | 195 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 200.065g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 14 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 200.185g/mol |
| Monoisotopic Mass | 200.065g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.3 |
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