54716970 1 2 22 1 2 -1 1 5 255 1 2 0 0 2.5 0 -1 Compound Canonicalized 5 2021.10.14 1 Compound Complexity 7 E_COMPLEXITY 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Count Hydrogen Bond Acceptor 5 E_NHACCEPTORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 1 Count Hydrogen Bond Donor 5 E_NHDONORS 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 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 00000371000000000000020000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000000 IUPAC Name Allowed 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium IUPAC Name CAS-like Style 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium IUPAC Name Markup 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium IUPAC Name Preferred 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium IUPAC Name Systematic 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium IUPAC Name Traditional 1 2.7.0 Lexichem TK OpenEye Scientific Software 2021.10.14 hydride;titanium InChI Standard 1 1.0.6 InChI iupac.org 2021.10.14 InChI=1S/Ti.H/q;-1 InChIKey Standard 1 1.0.6 InChI iupac.org 2021.10.14 GCSUFFNZXDGOEP-UHFFFAOYSA-N Mass Exact 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 48.9557657 Molecular Formula 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 HTi- Molecular Weight 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 48.875 SMILES Canonical 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [H-].[Ti] SMILES Isomeric 1 2.3.0 OEChem OpenEye Scientific Software 2021.10.14 [H-].[Ti] Topological Polar Surface Area 7 E_TPSA 3.4.8.18 Cactvs Xemistry GmbH 2021.10.14 0 Weight MonoIsotopic 1 2.2 PubChem ncbi.nlm.nih.gov 2021.10.14 48.9557657 1 0 0 0 0 0 0 0 2 -1