tetrachlorotitanium;trihydrate

H6Cl4O3Ti — CID 175768043

IUPACtetrachlorotitanium;trihydrate
SMILESCl[Ti](Cl)(Cl)Cl.O.O.O
InChIInChI=1S/4ClH.3H2O.Ti/h4*1H;3*1H2;/q;;;;;;;+4/p-4
InChIKeyXLYOFDCZCHMYGX-UHFFFAOYSA-J
MW243.72 g/mol
LogP0.28
Rot. Bonds

About tetrachlorotitanium;trihydrate

tetrachlorotitanium;trihydrate (PubChem CID 175768043) has the molecular formula H6Cl4O3Ti and a molecular weight of 243.72 g/mol. Its IUPAC name is tetrachlorotitanium;trihydrate.

Molecular Properties

Compound Nametetrachlorotitanium;trihydrate
PubChem CID175768043
Molecular FormulaH6Cl4O3Ti
Molecular Weight243.72 g/mol
Exact Mass241.86
IUPAC Nametetrachlorotitanium;trihydrate
SMILESCl[Ti](Cl)(Cl)Cl.O.O.O
InChIInChI=1S/4ClH.3H2O.Ti/h4*1H;3*1H2;/q;;;;;;;+4/p-4
InChIKeyXLYOFDCZCHMYGX-UHFFFAOYSA-J
XLogP0.28
TPSA94.50 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.72
LogP ≤ 50.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze tetrachlorotitanium;trihydrate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of tetrachlorotitanium;trihydrate?
The IUPAC name of tetrachlorotitanium;trihydrate (CID 175768043) is tetrachlorotitanium;trihydrate.
What is the SMILES notation for tetrachlorotitanium;trihydrate?
The canonical SMILES for tetrachlorotitanium;trihydrate is Cl[Ti](Cl)(Cl)Cl.O.O.O.
What is the InChIKey of tetrachlorotitanium;trihydrate?
The InChIKey is XLYOFDCZCHMYGX-UHFFFAOYSA-J. The full InChI is InChI=1S/4ClH.3H2O.Ti/h4*1H;3*1H2;/q;;;;;;;+4/p-4.
What are the key properties of tetrachlorotitanium;trihydrate?
tetrachlorotitanium;trihydrate has a molecular weight of 243.72 g/mol, XLogP of 0.28, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetrachlorotitanium;trihydrate is sourced from PubChem (CID 175768043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).