N1X
Summary
| Name: | (2S)-2-(5-methylfuran-2-yl)oxane |
| Formula: | C10 H14 O2 |
| Formal charge: | 0 |
| Formula weight: | 166.217 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2S)-2-(5-methylfuran-2-yl)oxane |
| OpenEye OEToolkits | 2.0.7 | (2~{S})-2-(5-methylfuran-2-yl)oxane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Cc1oc(cc1)C1CCCCO1 |
| InChI | InChI | 1.03 | InChI=1S/C10H14O2/c1-8-5-6-10(12-8)9-4-2-3-7-11-9/h5-6,9H,2-4,7H2,1H3/t9-/m0/s1 |
| InChIKey | InChI | 1.03 | LFPRQMKTEKLYDA-VIFPVBQESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1oc(cc1)[C@@H]2CCCCO2 |
| SMILES | CACTVS | 3.385 | Cc1oc(cc1)[CH]2CCCCO2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | Cc1ccc(o1)[C@@H]2CCCCO2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | Cc1ccc(o1)C2CCCCO2 |
