DEC
Summary
Name: | SEBACIC ACID |
Formula: | C10 H18 O4 |
Formal charge: | 0 |
Formula weight: | 202.248 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | decanedioic acid |
OpenEye OEToolkits | 1.5.0 | decanedioic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=C(O)CCCCCCCCC(=O)O |
SMILES_CANONICAL | CACTVS | 3.341 | OC(=O)CCCCCCCCC(O)=O |
SMILES | CACTVS | 3.341 | OC(=O)CCCCCCCCC(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(CCCCC(=O)O)CCCC(=O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(CCCCC(=O)O)CCCC(=O)O |
InChI | InChI | 1.03 | InChI=1S/C10H18O4/c11-9(12)7-5-3-1-2-4-6-8-10(13)14/h1-8H2,(H,11,12)(H,13,14) |
InChIKey | InChI | 1.03 | CXMXRPHRNRROMY-UHFFFAOYSA-N |