HE4
Summary
| Name: | HEPTAN-1-OL |
| Formula: | C7 H16 O |
| Formal charge: | 0 |
| Formula weight: | 116.201 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | heptan-1-ol |
| OpenEye OEToolkits | 1.5.0 | heptan-1-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | OCCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCO |
| SMILES | CACTVS | 3.341 | CCCCCCCO |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCO |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCO |
| InChI | InChI | 1.03 | InChI=1S/C7H16O/c1-2-3-4-5-6-7-8/h8H,2-7H2,1H3 |
| InChIKey | InChI | 1.03 | BBMCTIGTTCKYKF-UHFFFAOYSA-N |
