57451293 1 2 22 22 1 5 255 1 2 0 0 0 2.5 0 Compound Canonicalized 5 2012.05.21 1 Compound Complexity 7 E_COMPLEXITY 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Count Rotatable Bond 5 E_NROTBONDS 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Fingerprint SubStructure Keys 16 extended 2 E_SCREEN 3.4.6.11 Cactvs xemistry.com 2019.06.18 00000371000000000000020000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium IUPAC Name CAS-like Style 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium IUPAC Name Markup 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium IUPAC Name Preferred 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium IUPAC Name Systematic 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium IUPAC Name Traditional 1 2.6.6 LexiChem openeye.com 2019.06.18 titanium InChI Standard 1 1.0.5 InChI iupac.org 2019.06.18 InChI=1S/2Ti InChIKey Standard 1 1.0.5 InChI iupac.org 2019.06.18 NMJKIRUDPFBRHW-UHFFFAOYSA-N Mass Exact 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 95.895881 Molecular Formula 1 2.1 PubChem ncbi.nlm.nih.gov 2019.06.18 Ti2 Molecular Weight 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 95.73 SMILES Canonical 1 2.1.5 OEChem openeye.com 2019.06.18 [Ti].[Ti] SMILES Isomeric 1 2.1.5 OEChem openeye.com 2019.06.18 [Ti].[Ti] Topological Polar Surface Area 7 E_TPSA 3.4.6.11 Cactvs xemistry.com 2019.06.18 0 Weight MonoIsotopic 1 2.1 PubChem ncbi.nlm.nih.gov 2021.05.07 95.895881 2 0 0 0 0 0 0 0 2 -1