27K
Summary
| Name: | butyl 4-hydroxybenzoate |
| Formula: | C11 H14 O3 |
| Formal charge: | 0 |
| Formula weight: | 194.227 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | butyl 4-hydroxybenzoate |
| OpenEye OEToolkits | 1.7.6 | butyl 4-oxidanylbenzoate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(OCCCC)c1ccc(O)cc1 |
| InChI | InChI | 1.03 | InChI=1S/C11H14O3/c1-2-3-8-14-11(13)9-4-6-10(12)7-5-9/h4-7,12H,2-3,8H2,1H3 |
| InChIKey | InChI | 1.03 | QFOHBWFCKVYLES-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCCCOC(=O)c1ccc(O)cc1 |
| SMILES | CACTVS | 3.385 | CCCCOC(=O)c1ccc(O)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCCCOC(=O)c1ccc(cc1)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CCCCOC(=O)c1ccc(cc1)O |
