S9L
Summary
Name: | 2-[2-(2-HYDROXYETHOXY)ETHOXY]ETHYL DIHYDROGEN PHOSPHATE |
Formula: | C6 H15 O7 P |
Formal charge: | 0 |
Formula weight: | 230.153 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 2-[2-(2-hydroxyethoxy)ethoxy]ethyl dihydrogen phosphate |
OpenEye OEToolkits | 1.5.0 | 2-[2-(2-hydroxyethoxy)ethoxy]ethyl dihydrogen phosphate |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(OCCOCCOCCO)(O)O |
SMILES_CANONICAL | CACTVS | 3.341 | OCCOCCOCCO[P](O)(O)=O |
SMILES | CACTVS | 3.341 | OCCOCCOCCO[P](O)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(COCCOCCOP(=O)(O)O)O |
SMILES | OpenEye OEToolkits | 1.5.0 | C(COCCOCCOP(=O)(O)O)O |
InChI | InChI | 1.03 | InChI=1S/C6H15O7P/c7-1-2-11-3-4-12-5-6-13-14(8,9)10/h7H,1-6H2,(H2,8,9,10) |
InChIKey | InChI | 1.03 | CJHGCXGTUHBMMH-UHFFFAOYSA-N |