BDD
Summary
Name: | BROMO-DODECANOL |
Formula: | C12 H25 Br O |
Formal charge: | 0 |
Formula weight: | 265.23 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 12-bromododecan-1-ol |
OpenEye OEToolkits | 1.5.0 | 12-bromododecan-1-ol |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | BrCCCCCCCCCCCCO |
SMILES_CANONICAL | CACTVS | 3.341 | OCCCCCCCCCCCCBr |
SMILES | CACTVS | 3.341 | OCCCCCCCCCCCCBr |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CCCCCCBr)CCCCCO |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CCCCCCBr)CCCCCO |
InChI | InChI | 1.03 | InChI=1S/C12H25BrO/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h14H,1-12H2 |
InChIKey | InChI | 1.03 | ASIDMJNTHJYVQJ-UHFFFAOYSA-N |