bis(dioxotitanium);oxoalumane

HAlO5Ti2 — CID 174872718

IUPACbis(dioxotitanium);oxoalumane
SMILESO=[AlH].O=[Ti]=O.O=[Ti]=O
InChIInChI=1S/Al.5O.2Ti.H
InChIKeyCSLZAZGJRNOZJC-UHFFFAOYSA-N
MW203.72 g/mol
LogP-1.25
Rot. Bonds

About bis(dioxotitanium);oxoalumane

bis(dioxotitanium);oxoalumane (PubChem CID 174872718) has the molecular formula HAlO5Ti2 and a molecular weight of 203.72 g/mol. Its IUPAC name is bis(dioxotitanium);oxoalumane.

Molecular Properties

Compound Namebis(dioxotitanium);oxoalumane
PubChem CID174872718
Molecular FormulaHAlO5Ti2
Molecular Weight203.72 g/mol
Exact Mass203.86
IUPAC Namebis(dioxotitanium);oxoalumane
SMILESO=[AlH].O=[Ti]=O.O=[Ti]=O
InChIInChI=1S/Al.5O.2Ti.H
InChIKeyCSLZAZGJRNOZJC-UHFFFAOYSA-N
XLogP-1.25
TPSA85.35 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.72
LogP ≤ 5-1.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of bis(dioxotitanium);oxoalumane?
The IUPAC name of bis(dioxotitanium);oxoalumane (CID 174872718) is bis(dioxotitanium);oxoalumane.
What is the SMILES notation for bis(dioxotitanium);oxoalumane?
The canonical SMILES for bis(dioxotitanium);oxoalumane is O=[AlH].O=[Ti]=O.O=[Ti]=O.
What is the InChIKey of bis(dioxotitanium);oxoalumane?
The InChIKey is CSLZAZGJRNOZJC-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.5O.2Ti.H.
What are the key properties of bis(dioxotitanium);oxoalumane?
bis(dioxotitanium);oxoalumane has a molecular weight of 203.72 g/mol, XLogP of -1.25, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for bis(dioxotitanium);oxoalumane is sourced from PubChem (CID 174872718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).