H6N
Summary
| Name: | Protocatechuic aldehyde |
| Formula: | C7 H6 O3 |
| Formal charge: | 0 |
| Formula weight: | 138.121 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 3,4-bis(oxidanyl)benzaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C7H6O3/c8-4-5-1-2-6(9)7(10)3-5/h1-4,9-10H |
| InChIKey | InChI | 1.03 | IBGBGRVKPALMCQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(C=O)cc1O |
| SMILES | CACTVS | 3.385 | Oc1ccc(C=O)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1C=O)O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(c(cc1C=O)O)O |
