Record Information
Version1.0
Creation date2010-04-08 22:11:30 UTC
Update date2015-07-20 23:11:49 UTC
Primary IDFDB014837
Secondary Accession NumbersNot Available
Chemical Information
FooDB NameTitanium(IV) oxide (TiO2)
DescriptionTitanium(IV) oxide (TiO2) belongs to the class of inorganic compounds known as miscellaneous mixed metal/non-metals. These are inorganic compounds containing non-metal as well as metal atoms but not belonging to afore mentioned classes. Titanium(IV) oxide (TiO2) is an extremely weak basic (essentially neutral) compound (based on its pKa).
CAS Number13463-67-7
Structure
Thumb
Synonyms
SynonymSource
[TiO2]biospider
63B1 Whitebiospider
A 200 (pigment)biospider
A 330 (pigment)biospider
A-filbiospider
A-FN 3biospider
Aerolyst 7710biospider
Aerosil P 25biospider
Aerosil P 25S6biospider
Aerosil P 27biospider
Aerosil T 805biospider
AK 15 (pigment)biospider
Amperit 780.0biospider
Anatasebiospider
Anatase (TiO2)biospider
Anatase titanium dioxidebiospider
Atlas white titanium dioxidebiospider
Austioxbiospider
Austiox r-CRbiospider
Austiox R-CR 3biospider
B 101 (pigment)biospider
Bayer R-FD 1biospider
Bayeri tianbiospider
Bayeritianbiospider
Bayertitandb_source
Bayertitan abiospider
Bayertitan AN 3biospider
Bayertitan R-FD 1biospider
Bayertitan R-FK 21biospider
Bayertitan r-FK-dbiospider
Bayertitan R-KB 2biospider
Bayertitan R-KB 3biospider
Bayertitan R-KB 4biospider
Bayertitan R-KB 5biospider
Bayertitan R-KB 6biospider
Bayertitan R-U 2biospider
Bayertitan r-u-fbiospider
Bayertitan R-V-SE 20biospider
Bayertitan tbiospider
Baytitanbiospider
Bistrater L-NSC 200Cbiospider
Blend White 9202biospider
Brookitebiospider
C 97 (oxide)biospider
C-Weiss 7biospider
C-Weiss 7 (GERMAN)biospider
C.I. 77891db_source
C.I. Pigment White 6biospider
Cab-o-tibiospider
Calcotone white tbiospider
CG-tbiospider
CI Pigment white 6biospider
Cosmetic Hydrophobic TiO2 9428biospider
Cosmetic Micro Blend TiO2 9228biospider
Cosmetic White C47-5175biospider
Cosmetic White C47-9623biospider
Dioxido de titaniobiospider
Dioxotitaniumbiospider
Dioxyde de titanebiospider
E171db_source
Flamencobiospider
Hombikatbiospider
Hombita nbiospider
Hombitanbiospider
Hombitan R 101Dbiospider
Hombitan R 610Kbiospider
Horse head a-410biospider
Horse head a-420biospider
Horse head r-710biospider
Kronosbiospider
Kronos 1002biospider
Kronos 2073biospider
Kronos CL 220biospider
Kronos RN 40Pbiospider
Kronos RN 56biospider
Kronos titanium dioxidebiospider
Levanox white RKBbiospider
MC 50 (oxide)biospider
Nano-anatasebiospider
nano-TiO2biospider
NT 100 (oxide)biospider
Octahedritebiospider
Octahedrite (mineral)biospider
Orgasol 1002D White 10 Extra Cosbiospider
Oxido de titanio(IV)biospider
P 25 (oxide)biospider
Pigment White 6biospider
R 830 (mineral)biospider
Rayoxbiospider
ru na arh 200biospider
Runa ARH 20biospider
Runa ARH 200biospider
Runa rh20biospider
Rutilebiospider
Rutile (TiO2)biospider
Rutile titanium dioxidebiospider
Rutiox CRbiospider
S 150 (oxide)biospider
Sagenitebiospider
Ti-purebiospider
ti-pure r 101biospider
ti-pure r 90 0biospider
Ti-Pure R 900biospider
Ti-Pure R 901biospider
ti-pure r 915biospider
Tichlorbiospider
Tin dioxide dustbiospider
Tinoc M 6biospider
TiO2biospider
Tiofinebiospider
Tiona t.dbiospider
Tiona t.d.biospider
Tiona TDbiospider
Tioxidedb_source
Tioxide a-DMbiospider
Tioxide a-HRbiospider
Tioxide ad-mbiospider
Tioxide r XLbiospider
Tioxide r-CRbiospider
Tioxide r-SMbiospider
Tioxide r.XLbiospider
Tioxide RHDbiospider
Tioxide RSMbiospider
Tipaquebiospider
Tipaque R 820biospider
Titafrancebiospider
Titan whitebiospider
Titandioxidbiospider
Titandioxid (sweden)biospider
Titandioxid [swedish]biospider
Titaniadb_source
Titanic acid anhydridebiospider
Titanic anhydridebiospider
Titanic oxidebiospider
Titanium (IV) oxidebiospider
Titanium dioxidebiospider
Titanium dioxide (anatase)biospider
Titanium dioxide (rutile)biospider
Titanium dioxide (TiO2)biospider
Titanium dioxide (usp)biospider
TITANIUM DIOXIDE P25biospider
Titanium dioxide, extremely fine-crystallinebiospider
Titanium dioxide, USANdb_source
Titanium oxidedb_source
Titanium oxide (JP15)biospider
Titanium oxide (TiO2)biospider
Titanium oxide (van)biospider
Titanium oxide, TiO2biospider
Titanium peroxidebiospider
Titanium peroxide (TiO2)biospider
Titanium whitebiospider
Titanium(IV) oxidebiospider
Titanium(IV) oxide, anatasebiospider
Titanium(IV) oxide, mixture of rutile and anatasebiospider
Titanium(IV) oxide, rutilebiospider
Titanium(IV)dioxidebiospider
Titanoxbiospider
Titanox 2010biospider
Titanox rancbiospider
Trioxide(s)biospider
Tronoxbiospider
Unitanedb_source
Unitane 0-110biospider
Unitane 0-220biospider
Unitane o-110biospider
Unitane o-220biospider
Unitane orbiospider
Unitane OR 450biospider
unitane or 572biospider
Unitane OR 650biospider
Unitane or-150biospider
Unitane or-340biospider
Unitane or-342biospider
Unitane or-350biospider
Unitane or-540biospider
Unitane or-640biospider
Uniwhite aobiospider
Uniwhite kobiospider
Uniwhite OR 450biospider
Uniwhite OR 650biospider
Zopaquebiospider
Zopaque LDCbiospider
Predicted Properties
PropertyValueSource
logP0ChemAxon
pKa (Strongest Acidic)15.7ChemAxon
pKa (Strongest Basic)-1.8ChemAxon
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area0 ŲChemAxon
Rotatable Bond Count0ChemAxon
Refractivity0 m³·mol⁻¹ChemAxon
Polarizability1.78 ųChemAxon
Number of Rings0ChemAxon
BioavailabilityYesChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Chemical FormulaO2Ti
IUPAC nametitanium(4+) ion dioxidandiide
InChI IdentifierInChI=1S/2O.Ti/q2*-2;+4
InChI KeySOQBVABWOPYFQZ-UHFFFAOYSA-N
Isomeric SMILES[O--].[O--].[Ti+4]
Average Molecular Weight79.866
Monoisotopic Molecular Weight79.937776297
Classification
Description Belongs to the class of inorganic compounds known as miscellaneous mixed metal/non-metals. These are inorganic compounds containing non-metal as well as metal atoms but not belonging to afore mentioned classes.
KingdomInorganic compounds
Super ClassMixed metal/non-metal compounds
ClassMiscellaneous mixed metal/non-metals
Sub ClassNot Available
Direct ParentMiscellaneous mixed metal/non-metals
Alternative Parents
Substituents
  • Inorganic salt
  • Miscellaneous mixed metal/non-metal
Molecular FrameworkNot Available
External DescriptorsNot Available
Ontology
Disposition

Source:

Role

Biological role:

Physico-Chemical Properties
Physico-Chemical Properties - Experimental
PropertyValueReference
Physical stateNot Available
Physical DescriptionNot Available
Mass CompositionO 40.06%; Ti 59.94%DFC
Melting PointMp 1892 ° (under O2 atm.)DFC
Boiling PointNot Available
Experimental Water SolubilityNot Available
Experimental logPNot Available
Experimental pKaNot Available
Isoelectric pointNot Available
ChargeNot Available
Optical RotationNot Available
Spectroscopic UV DataNot Available
DensityNot Available
Refractive IndexNot Available
Spectra
SpectraNot Available
ChemSpider IDNot Available
ChEMBL IDNot Available
KEGG Compound IDNot Available
Pubchem Compound ID26042
Pubchem Substance IDNot Available
ChEBI ID32234
Phenol-Explorer IDNot Available
DrugBank IDNot Available
HMDB IDHMDB36020
CRC / DFC (Dictionary of Food Compounds) IDJWP28-B:JWP28-B
EAFUS ID3679
Dr. Duke IDNot Available
BIGG IDNot Available
KNApSAcK IDNot Available
HET IDNot Available
Food Biomarker OntologyNot Available
VMH IDNot Available
Flavornet IDNot Available
GoodScent IDNot Available
SuperScent IDNot Available
Wikipedia IDNot Available
Phenol-Explorer Metabolite IDNot Available
Duplicate IDSNot Available
Old DFC IDSNot Available
Associated Foods
FoodContent Range AverageReference
FoodReference
Biological Effects and Interactions
Health Effects / BioactivitiesNot Available
EnzymesNot Available
PathwaysNot Available
MetabolismNot Available
BiosynthesisNot Available
Organoleptic Properties
FlavoursNot Available
Files
MSDSNot Available
References
Synthesis ReferenceNot Available
General ReferenceNot Available
Content Reference