HP6
Summary
| Name: | HEPTANE |
| Formula: | C7 H16 |
| Formal charge: | 0 |
| Formula weight: | 100.202 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | heptane |
| OpenEye OEToolkits | 1.5.0 | heptane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | CCCCCCC |
| SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCC |
| SMILES | CACTVS | 3.341 | CCCCCCC |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCC |
| InChI | InChI | 1.03 | InChI=1S/C7H16/c1-3-5-7-6-4-2/h3-7H2,1-2H3 |
| InChIKey | InChI | 1.03 | IMNFDUFMRHMDMM-UHFFFAOYSA-N |
