U5N
Summary
| Name: | (2~{R})-2-methyl-2~{H}-furan-5-one |
| Formula: | C5 H6 O2 |
| Formal charge: | 0 |
| Formula weight: | 98.1 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (2~{R})-2-methyl-2~{H}-furan-5-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C5H6O2/c1-4-2-3-5(6)7-4/h2-4H,1H3/t4-/m1/s1 |
| InChIKey | InChI | 1.03 | BGLUXFNVVSVEET-SCSAIBSYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C[C@H]1OC(=O)C=C1 |
| SMILES | CACTVS | 3.385 | C[CH]1OC(=O)C=C1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[C@@H]1C=CC(=O)O1 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC1C=CC(=O)O1 |
