4PA
Summary
| Name: | PROPYL ACETATE |
| Formula: | C5 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 102.132 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | propyl acetate |
| OpenEye OEToolkits | 1.5.0 | propyl ethanoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C(OCCC)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCOC(C)=O |
| SMILES | CACTVS | 3.341 | CCCOC(C)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCOC(=O)C |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCOC(=O)C |
| InChI | InChI | 1.03 | InChI=1S/C5H10O2/c1-3-4-7-5(2)6/h3-4H2,1-2H3 |
| InChIKey | InChI | 1.03 | YKYONYBAUNKHLG-UHFFFAOYSA-N |
