66051 1 2 3 4 5 6 8 8 8 6 1 1 1 1 2 3 4 2 4 6 4 5 1 1 1 2 1 1 5 255 1 2 3 4 5 6 3.403 2.5369 5.135 4.269 4.269 2 -0.56 -0.06 -0.56 -0.06 0.56 -0.37 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 17.2 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 3 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 1 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0000037100003000000000000000000000000000000000000000000000000000000000000000001200000C000000000000030008000000000800000088000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 peroxyformic acid IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 peroxyformic acid IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 peroxyformic acid IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 peroxyformic acid IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 methaneperoxoic acid IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 performic acid InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/CH2O3/c2-1-4-3/h1,3H InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 SCKXCAADGDQQCS-UHFFFAOYSA-N Log P XLogP3-AA 7 3.0 sioc-ccbg.ac.cn 2021.10.14 -0.4 Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 62.000393922 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 CH2O3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 62.025 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(=O)OO SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 C(=O)OO Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 46.5 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 62.000393922 4 0 0 0 0 0 0 0 1 -1