O4B
Summary
Name: | 1,4,7,10,13,16-HEXAOXACYCLOOCTADECANE |
Formula: | C12 H24 O6 |
Formal charge: | 0 |
Formula weight: | 264.315 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1,4,7,10,13,16-hexaoxacyclooctadecane |
OpenEye OEToolkits | 1.9.2 | 1,4,7,10,13,16-hexaoxacyclooctadecane |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O1CCOCCOCCOCCOCCOCC1 |
InChI | InChI | 1.03 | InChI=1S/C12H24O6/c1-2-14-5-6-16-9-10-18-12-11-17-8-7-15-4-3-13-1/h1-12H2 |
InChIKey | InChI | 1.03 | XEZNGIUYQVAUSS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | C1COCCOCCOCCOCCOCCO1 |
SMILES | CACTVS | 3.385 | C1COCCOCCOCCOCCOCCO1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1COCCOCCOCCOCCOCCO1 |
SMILES | OpenEye OEToolkits | 1.9.2 | C1COCCOCCOCCOCCOCCO1 |