phosphoric acid;titanium

H3O4PTi2 — CID 139211571

IUPACphosphoric acid;titanium
SMILESO=P(O)(O)O.[Ti].[Ti]
InChIInChI=1S/H3O4P.2Ti/c1-5(2,3)4;;/h(H3,1,2,3,4);;
InChIKeyYRHRHOFDDCOPIF-UHFFFAOYSA-N
MW193.73 g/mol
LogP-0.93
Rot. Bonds

About phosphoric acid;titanium

phosphoric acid;titanium (PubChem CID 139211571) has the molecular formula H3O4PTi2 and a molecular weight of 193.73 g/mol. Its IUPAC name is phosphoric acid;titanium.

Molecular Properties

Compound Namephosphoric acid;titanium
PubChem CID139211571
Molecular FormulaH3O4PTi2
Molecular Weight193.73 g/mol
Exact Mass193.87
IUPAC Namephosphoric acid;titanium
SMILESO=P(O)(O)O.[Ti].[Ti]
InChIInChI=1S/H3O4P.2Ti/c1-5(2,3)4;;/h(H3,1,2,3,4);;
InChIKeyYRHRHOFDDCOPIF-UHFFFAOYSA-N
XLogP-0.93
TPSA77.76 Ų
H-Bond Donors3
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.73
LogP ≤ 5-0.93
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

phosphoric acid;titanium
CID 173034953
CID 173097851
CID 173097851
CID 22052907
CID 22052907
phosphoric acid;titanium;hydrate
CID 173357749
methane;phosphoric acid
CID 18515646
phosphoric acid;hydrate
CID 22023151
phosphane;phosphoric acid
CID 172840180
hydrogen peroxide;phosphoric acid
CID 18509931
CID 159816390
CID 159816390
CID 173050648
CID 173050648
methane;phosphoric acid
CID 173400304
cerium;phosphoric acid
CID 90659592

Frequently Asked Questions

What is the IUPAC name of phosphoric acid;titanium?
The IUPAC name of phosphoric acid;titanium (CID 139211571) is phosphoric acid;titanium.
What is the SMILES notation for phosphoric acid;titanium?
The canonical SMILES for phosphoric acid;titanium is O=P(O)(O)O.[Ti].[Ti].
What is the InChIKey of phosphoric acid;titanium?
The InChIKey is YRHRHOFDDCOPIF-UHFFFAOYSA-N. The full InChI is InChI=1S/H3O4P.2Ti/c1-5(2,3)4;;/h(H3,1,2,3,4);;.
What are the key properties of phosphoric acid;titanium?
phosphoric acid;titanium has a molecular weight of 193.73 g/mol, XLogP of -0.93, 0 rotatable bonds, 3 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for phosphoric acid;titanium is sourced from PubChem (CID 139211571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).