QY9
Summary
Name: | phenyl acetate |
Formula: | C8 H8 O2 |
Formal charge: | 0 |
Formula weight: | 136.148 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | phenyl acetate |
OpenEye OEToolkits | 1.7.6 | phenyl ethanoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(Oc1ccccc1)C |
InChI | InChI | 1.03 | InChI=1S/C8H8O2/c1-7(9)10-8-5-3-2-4-6-8/h2-6H,1H3 |
InChIKey | InChI | 1.03 | IPBVNPXQWQGGJP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)Oc1ccccc1 |
SMILES | CACTVS | 3.385 | CC(=O)Oc1ccccc1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CC(=O)Oc1ccccc1 |
SMILES | OpenEye OEToolkits | 1.7.6 | CC(=O)Oc1ccccc1 |