7628 1 2 3 4 5 6 7 8 8 8 5 1 1 1 1 1 2 2 3 3 4 5 4 6 4 7 1 1 1 1 1 1 1 5 255 1 2 3 4 5 6 7 4.269 2.5369 3.403 3.403 4.8059 2 2.866 0.905 0.905 -0.595 0.405 0.595 0.595 -0.905 0 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 8 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 3 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 00000371020030000000000000000000000000000000000000000000000000000000000000000800000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 boric acid InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/BH3O3/c2-1(3)4/h2-4H InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 KGBXLFKZBHKPEV-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 62.0175241 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 BH3O3 Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 61.84 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 B(O)(O)O SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 B(O)(O)O Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 60.7 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 62.0175241 4 0 0 0 0 0 0 0 1 -1