14791 1 2 3 4 5 12 8 8 1 1 1 2 2 -1 3 -1 1 1 2 3 2 3 4 5 7 7 1 1 1 5 255 1 2 3 4 5 3.403 4.269 2.5369 4.8059 2 -0.25 0.25 0.25 -0.06 -0.06 0 Compound Canonicalized 5 2011.04.04 1 Compound Complexity 7 E_COMPLEXITY 3.408 Cactvs xemistry.com 2012.11.26 2.8 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.408 Cactvs xemistry.com 2012.11.26 2 Count Hydrogen Bond Donor 5 E_NHDONORS 3.408 Cactvs xemistry.com 2012.11.26 2 Count Rotatable Bond 5 E_NROTBONDS 3.408 Cactvs xemistry.com 2012.11.26 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.408 Cactvs xemistry.com 2012.11.26 00000371000030000000200000000000000000000000000000000000000000000000000000000000000008000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.2.0 LexiChem openeye.com 2012.11.26 magnesium;dihydroxide IUPAC Name CAS-like Style 1 2.2.0 LexiChem openeye.com 2012.11.26 magnesium;dihydroxide IUPAC Name Preferred 1 2.2.0 LexiChem openeye.com 2012.11.26 magnesium;dihydroxide IUPAC Name Systematic 1 2.2.0 LexiChem openeye.com 2012.11.26 magnesium;dihydroxide IUPAC Name Traditional 1 2.2.0 LexiChem openeye.com 2012.11.26 magnesium;dihydroxide InChI Standard 1 1.0.4 InChI iupac.org 2012.11.26 InChI=1S/Mg.2H2O/h;2*1H2/q+2;;/p-2 InChIKey Standard 1 1.0.4 InChI iupac.org 2012.11.26 VTHJTEIRLNZDEV-UHFFFAOYSA-L Mass Exact 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 57.990521 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 H2MgO2 Molecular Weight 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 58.31968 SMILES Canonical 1 1.9.0 OEChem openeye.com 2012.11.26 [OH-].[OH-].[Mg+2] SMILES Isomeric 1 1.9.0 OEChem openeye.com 2012.11.26 [OH-].[OH-].[Mg+2] Topological Polar Surface Area 7 E_TPSA 3.408 Cactvs xemistry.com 2012.11.26 2 Weight MonoIsotopic 7 2.1 PubChem ncbi.nlm.nih.gov 2012.11.26 57.990521 3 0 0 0 0 0 0 0 3 1