OC9
Summary
Name: | OCTAN-1-OL |
Formula: | C8 H18 O |
Formal charge: | 0 |
Formula weight: | 130.228 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | octan-1-ol |
OpenEye OEToolkits | 1.5.0 | octan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCCCCCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCO |
SMILES | CACTVS | 3.341 | CCCCCCCCO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCO |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCO |
InChI | InChI | 1.03 | InChI=1S/C8H18O/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3 |
InChIKey | InChI | 1.03 | KBPLFHHGFOOTCA-UHFFFAOYSA-N |