3AV
Summary
| Name: | 6-methyl-2H-chromen-2-one |
| Formula: | C10 H8 O2 |
| Formal charge: | 0 |
| Formula weight: | 160.169 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-methyl-2H-chromen-2-one |
| OpenEye OEToolkits | 1.9.2 | 6-methylchromen-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C2Oc1ccc(cc1C=C2)C |
| InChI | InChI | 1.03 | InChI=1S/C10H8O2/c1-7-2-4-9-8(6-7)3-5-10(11)12-9/h2-6H,1H3 |
| InChIKey | InChI | 1.03 | FXFYOPQLGGEACP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1ccc2OC(=O)C=Cc2c1 |
| SMILES | CACTVS | 3.385 | Cc1ccc2OC(=O)C=Cc2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | Cc1ccc2c(c1)C=CC(=O)O2 |
| SMILES | OpenEye OEToolkits | 1.9.2 | Cc1ccc2c(c1)C=CC(=O)O2 |
