33D
Summary
Name: | 3,3-DIMETHYLBUTAN-1-OL |
Formula: | C6 H14 O |
Formal charge: | 0 |
Formula weight: | 102.175 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 1.6.1 | 3,3-dimethylbutan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES_CANONICAL | CACTVS | 3.352 | CC(C)(C)CCO |
SMILES | CACTVS | 3.352 | CC(C)(C)CCO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | CC(C)(C)CCO |
SMILES | OpenEye OEToolkits | 1.6.1 | CC(C)(C)CCO |
InChI | InChI | 1.03 | InChI=1S/C6H14O/c1-6(2,3)4-5-7/h7H,4-5H2,1-3H3 |
InChIKey | InChI | 1.03 | DUXCSEISVMREAX-UHFFFAOYSA-N |