Obsolete: 6JZ
Summary
Name: | 3,6,9,12,15-pentaoxaheptadecane |
Synonyms: | Part of Jeffamine |
Formula: | C12 H26 O5 |
Formal charge: | 0 |
Formula weight: | 250.332 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 3,6,9,12,15-pentaoxaheptadecane |
OpenEye OEToolkits | 1.7.6 | 1-ethoxy-2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethane |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | CCOCCOCCOCCOCCOCC |
InChI | InChI | 1.03 | InChI=1S/C12H26O5/c1-3-13-5-7-15-9-11-17-12-10-16-8-6-14-4-2/h3-12H2,1-2H3 |
InChIKey | InChI | 1.03 | HYDWALOBQJFOMS-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCOCCOCCOCCOCCOCC |
SMILES | CACTVS | 3.385 | CCOCCOCCOCCOCCOCC |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | CCOCCOCCOCCOCCOCC |
SMILES | OpenEye OEToolkits | 1.7.6 | CCOCCOCCOCCOCCOCC |