VX
Summary
Name: | O-ETHYLMETHYLPHOSPHONIC ACID ESTER GROUP |
Formula: | C3 H9 O3 P |
Formal charge: | 0 |
Formula weight: | 124.076 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | ethyl hydrogen (S)-methylphosphonate |
OpenEye OEToolkits | 1.5.0 | ethoxy-methyl-phosphinic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=P(O)(OCC)C |
SMILES_CANONICAL | CACTVS | 3.341 | CCO[P@](C)(O)=O |
SMILES | CACTVS | 3.341 | CCO[P](C)(O)=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCO[P@](=O)(C)O |
SMILES | OpenEye OEToolkits | 1.5.0 | CCOP(=O)(C)O |
InChI | InChI | 1.03 | InChI=1S/C3H9O3P/c1-3-6-7(2,4)5/h3H2,1-2H3,(H,4,5) |
InChIKey | InChI | 1.03 | UFZOPKFMKMAWLU-UHFFFAOYSA-N |