1-[4-(2,2-Difluoroethoxy)phenyl]propan-1-one - CAS 1178045-63-0
Catalog: |
BB051650 |
Product Name: |
1-[4-(2,2-Difluoroethoxy)phenyl]propan-1-one |
CAS: |
1178045-63-0 |
Synonyms: |
1-[4-(2,2-difluoroethoxy)phenyl]propan-1-one |
IUPAC Name: | 1-[4-(2,2-difluoroethoxy)phenyl]propan-1-one |
Molecular Weight: | 214.21 |
Molecular Formula: | C11H12F2O2 |
Canonical SMILES: | CCC(=O)C1=CC=C(C=C1)OCC(F)F |
InChI: | InChI=1S/C11H12F2O2/c1-2-10(14)8-3-5-9(6-4-8)15-7-11(12)13/h3-6,11H,2,7H2,1H3 |
InChI Key: | SHRPIHDZKJGNNK-UHFFFAOYSA-N |
Complexity: | 199 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 214.08053595 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 214.08053595 |
Rotatable Bond Count: | 5 |
Topological Polar Surface Area: | 26.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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