FW6
Summary
Name: | (3-ethylphenyl) dihydrogen phosphate |
Formula: | C8 H11 O4 P |
Formal charge: | 0 |
Formula weight: | 202.144 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (3-ethylphenyl) dihydrogen phosphate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H11O4P/c1-2-7-4-3-5-8(6-7)12-13(9,10)11/h3-6H,2H2,1H3,(H2,9,10,11) |
InChIKey | InChI | 1.03 | IEFUTYQGHXXRLJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCc1cccc(O[P](O)(O)=O)c1 |
SMILES | CACTVS | 3.385 | CCc1cccc(O[P](O)(O)=O)c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1cccc(c1)OP(=O)(O)O |
SMILES | OpenEye OEToolkits | 2.0.7 | CCc1cccc(c1)OP(=O)(O)O |