4HC
Summary
| Name: | 4-HYDROXY-2H-CHROMEN-2-ONE |
| Synonyms: | 4-HYDROXY-1-BENZOPYRAN-2-ONE 4-HYDROXYCOUMARIN |
| Formula: | C9 H6 O3 |
| Formal charge: | 0 |
| Formula weight: | 162.142 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4-hydroxy-2H-chromen-2-one |
| OpenEye OEToolkits | 1.5.0 | 4-hydroxychromen-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C2Oc1ccccc1C(O)=C2 |
| SMILES_CANONICAL | CACTVS | 3.341 | OC1=CC(=O)Oc2ccccc12 |
| SMILES | CACTVS | 3.341 | OC1=CC(=O)Oc2ccccc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)C(=CC(=O)O2)O |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)C(=CC(=O)O2)O |
| InChI | InChI | 1.03 | InChI=1S/C9H6O3/c10-7-5-9(11)12-8-4-2-1-3-6(7)8/h1-5,10H |
| InChIKey | InChI | 1.03 | VXIXUWQIVKSKSA-UHFFFAOYSA-N |
