alumane;titanium;trifluoroborane

H3AlBF3Ti — CID 175073952

IUPACalumane;titanium;trifluoroborane
SMILESFB(F)F.[AlH3].[Ti]
InChIInChI=1S/Al.BF3.Ti.3H/c;2-1(3)4;;;;
InChIKeyVBXGJWAXTFNYEK-UHFFFAOYSA-N
MW145.68 g/mol
LogP-0.31
Rot. Bonds

About alumane;titanium;trifluoroborane

alumane;titanium;trifluoroborane (PubChem CID 175073952) has the molecular formula H3AlBF3Ti and a molecular weight of 145.68 g/mol. Its IUPAC name is alumane;titanium;trifluoroborane.

Molecular Properties

Compound Namealumane;titanium;trifluoroborane
PubChem CID175073952
Molecular FormulaH3AlBF3Ti
Molecular Weight145.68 g/mol
Exact Mass145.96
IUPAC Namealumane;titanium;trifluoroborane
SMILESFB(F)F.[AlH3].[Ti]
InChIInChI=1S/Al.BF3.Ti.3H/c;2-1(3)4;;;;
InChIKeyVBXGJWAXTFNYEK-UHFFFAOYSA-N
XLogP-0.31
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.68
LogP ≤ 5-0.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of alumane;titanium;trifluoroborane?
The IUPAC name of alumane;titanium;trifluoroborane (CID 175073952) is alumane;titanium;trifluoroborane.
What is the SMILES notation for alumane;titanium;trifluoroborane?
The canonical SMILES for alumane;titanium;trifluoroborane is FB(F)F.[AlH3].[Ti].
What is the InChIKey of alumane;titanium;trifluoroborane?
The InChIKey is VBXGJWAXTFNYEK-UHFFFAOYSA-N. The full InChI is InChI=1S/Al.BF3.Ti.3H/c;2-1(3)4;;;;.
What are the key properties of alumane;titanium;trifluoroborane?
alumane;titanium;trifluoroborane has a molecular weight of 145.68 g/mol, XLogP of -0.31, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for alumane;titanium;trifluoroborane is sourced from PubChem (CID 175073952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).