11A
Summary
Name: | UNDECANOIC ACID |
Formula: | C11 H22 O2 |
Formal charge: | 0 |
Formula weight: | 186.291 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | undecanoic acid |
OpenEye OEToolkits | 1.5.0 | undecanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCCCC |
SMILES_CANONICAL | CACTVS | 3.341 | CCCCCCCCCCC(O)=O |
SMILES | CACTVS | 3.341 | CCCCCCCCCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCC(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CCCCCCCCCCC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13) |
InChIKey | InChI | 1.03 | ZDPHROOEEOARMN-UHFFFAOYSA-N |