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CHEBI:231499 - titanium tetrachloride

ChEBI IDCHEBI:231499
ChEBI Nametitanium tetrachloride
Stars
DefinitionA titanium molecular entity that is titanium which carries 4 chlorine atoms.
Last Modified6 June 2024
SubmitterNoura Rayya
DownloadsMolfile
FormulaCl4Ti
Net Charge0
Average Mass189.679
Monoisotopic Mass187.82336
SMILES[Cl][Ti]([Cl])([Cl])[Cl]
InChIInChI=1S/4ClH.Ti/h4*1H;/q;;;;+4/p-4
InChIKeyXJDNKRIXUMDJCW-UHFFFAOYSA-J
Wikipedia
Roles Classification
Chemical Role:
NMR chemical shift reference compound  Any compound that produces a peak used as reference frequency in the δ chemical shift scale.
Application:
NMR chemical shift reference compound  Any compound that produces a peak used as reference frequency in the δ chemical shift scale.
ChEBI Ontology
Outgoing Relation(s)
titanium tetrachloride (CHEBI:231499) has role NMR chemical shift reference compound (CHEBI:228364)
titanium tetrachloride (CHEBI:231499) is a titanium molecular entity (CHEBI:37217)
IUPAC Name 
titanium(4+) tetrachloride
Synonyms  Source
titanium(IV) chlorideChEBI
titanium chlorideChEBI
tetrachlorotitaniumChEBI
titanium chloride (TiCl4)ChEBI
TiCl4ChEBI
titanium(IV) tetrachlorideChEBI
Manual XrefsDatabases
Titanium_tetrachlorideWikipedia
Registry NumbersSources
CAS:7550-45-0NIST Chemistry WebBook
Citations