HE2
Summary
Name: | HEXAN-1-OL |
Formula: | C6 H14 O |
Formal charge: | 0 |
Formula weight: | 102.175 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | hexan-1-ol |
OpenEye OEToolkits | 1.5.0 | hexan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | OCCCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCO |
SMILES | CACTVS | 3.341 | CCCCCCO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCO |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCO |
InChI | InChI | 1.03 | InChI=1S/C6H14O/c1-2-3-4-5-6-7/h7H,2-6H2,1H3 |
InChIKey | InChI | 1.03 | ZSIAUFGUXNUGDI-UHFFFAOYSA-N |