| CAS Number | 1402175-16-9 |
| Catalog Number | AG01A2HQ |
| Chemical Name | 2-(benzyloxy)-1-(4-fluorophenyl)ethan-1-one |
| IUPAC Name | 1-(4-fluorophenyl)-2-phenylmethoxyethanone |
| InChI | InChI=1S/C15H13FO2/c16-14-8-6-13(7-9-14)15(17)11-18-10-12-4-2-1-3-5-12/h1-9H,10-11H2 |
| InChI Key | MQDGSYIJHBYOQX-UHFFFAOYSA-N |
| MDL Number | MFCD15519577 |
| Molecular Formula | C15H13FO2 |
| Molecular Weight | 244.2609 |
| SMILES | FC1=CC=C(C(COCC2=CC=CC=C2)=O)C=C1 |
| Synonyms | 2-(benzyloxy)-1-(4-fluorophenyl)ethan-1-one,
1402175-16-9,
ZINC50159255,
AKOS011306022,
MCULE-5554487262,
NE32861,
Z1507502572,
|
| Complexity | 253 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 244.09g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 18 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 244.265g/mol |
| Monoisotopic Mass | 244.09g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 26.3A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 3.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number