Benzyl phenylacetate
CAS: 102-16-9
| 1 | Benzyl phenylacetate |
| 2 | benzyl 2-phenylacetate |
| 3 | BENZENEACETIC ACID, PHENYLMETHYL ESTER |
| 4 | Benzyl benzeneacetate |
| 5 | Benzyl alpha-toluate |
Phenylmethyl benzeneacetate is a carboxylic ester. It is functionally related to a benzyl alcohol.
| Molecular Formula | C15H14O2 |
|---|---|
| Canonical SMILES | C1=CC=C(C=C1)CC(=O)OCC2=CC=CC=C2 |
| Isomeric SMILES | C1=CC=C(C=C1)CC(=O)OCC2=CC=CC=C2 |
| Molecular Weight | 226.2700 |
| InChIKey | MIYFJEKZLFWKLZ-UHFFFAOYSA-N |
| InChI | InChI=1S/C15H14O2/c16-15(11-13-7-3-1-4-8-13)17-12-14-9-5-2-6-10-14/h1-10H,11-12H2 |
| XLogP | 3.2000 |
| ExactMass | 226.0994 |
| MonoisotopicMass | 226.0994 |
| TPSA | 26.3000 |
| Complexity | 225.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 2 |
| RotatableBondCount | 5 |
| HeavyAtomCount | 17 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 2529 |
| PatentFamilyCount | 973 |
| LiteratureCount | 47 |