2.0 2015-09-08 17:49:38 -0600 2015-09-08 17:49:38 -0600 ECMDB24138 M2MDB006255 Diethylphosphate Diethylphosphoric acid C4H11O4P 154.1015 154.039495352 diethoxyphosphinic acid diethyl phosphoric acid CCOP(O)(=O)OCC InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6) UCQFCFPECQILOL-UHFFFAOYSA-N logp 0.41 ALOGPS logs -0.54 ALOGPS solubility 4.41e+01 g/l ALOGPS logp 0.45 ChemAxon pka_strongest_acidic 1.95 ChemAxon iupac diethoxyphosphinic acid ChemAxon average_mass 154.1015 ChemAxon mono_mass 154.039495352 ChemAxon smiles CCOP(O)(=O)OCC ChemAxon formula C4H11O4P ChemAxon inchi InChI=1S/C4H11O4P/c1-3-7-9(5,6)8-4-2/h3-4H2,1-2H3,(H,5,6) ChemAxon inchikey UCQFCFPECQILOL-UHFFFAOYSA-N ChemAxon polar_surface_area 55.76 ChemAxon refractivity 33.11 ChemAxon polarizability 13.86 ChemAxon rotatable_bond_count 4 ChemAxon acceptor_count 2 ChemAxon donor_count 1 ChemAxon physiological_charge -1 ChemAxon formal_charge 0 ChemAxon Specdb::CMs 10738 Specdb::CMs 169791 Specdb::NmrOneD 11562 Specdb::NmrOneD 11563 Specdb::NmrOneD 11564 Specdb::NmrOneD 11565 Specdb::NmrOneD 11566 Specdb::NmrOneD 11567 Specdb::NmrOneD 11568 Specdb::NmrOneD 11569 Specdb::NmrOneD 11570 Specdb::NmrOneD 11571 Specdb::NmrOneD 11572 Specdb::NmrOneD 11573 Specdb::NmrOneD 11574 Specdb::NmrOneD 11575 Specdb::NmrOneD 11576 Specdb::NmrOneD 11577 Specdb::NmrOneD 11578 Specdb::NmrOneD 11579 Specdb::NmrOneD 11580 Specdb::NmrOneD 11581 Specdb::MsMs 26213 Specdb::MsMs 26214 Specdb::MsMs 26215 Specdb::MsMs 32771 Specdb::MsMs 32772 Specdb::MsMs 32773 Specdb::MsMs 437594 Specdb::MsMs 437595 Specdb::MsMs 437596 Specdb::MsMs 437597 Specdb::MsMs 437598 Specdb::MsMs 2460844 Specdb::MsMs 2460845 Specdb::MsMs 2460846 Specdb::MsMs 2478620 Specdb::MsMs 2478621 Specdb::MsMs 2478622