3085127 1 2 3 4 5 6 15 8 8 1 1 1 4 2 5 2 6 2 1 1 1 1 2 2 3 4 5 6 1 2 1 1 1 1 5 255 1 2 3 4 5 6 2.866 3.732 2 2.556 3.176 4.269 0 0.5 -0.5 0.5369 -0.5369 0.19 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 10.3 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Count Rotatable Bond 5 E_NROTBONDS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 00000371000030020000000000000000000000000000000000000000000000000000000000000000000008201000000000000000000000100040000000800000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/H3O2P/c1-3-2/h3H2,(H,1,2)/i3D2/hD InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 ACVYVLVWPXVTIT-DZCFLQKHSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -1.1 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 69.00589657 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 H3O2P Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 69.015 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 O[PH2]=O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [2H]OP(=O)([2H])[2H] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 37.3 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 69.00589657 3 0 0 0 0 0 0 3 1 -1