2-methylpropane;tribromotitanium

C4H10Br3Ti — CID 174154914

IUPAC2-methylpropane;tribromotitanium
SMILESBr[Ti](Br)Br.CC(C)C
InChIInChI=1S/C4H10.3BrH.Ti/c1-4(2)3;;;;/h4H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyWLDNPFBWHQWZJO-UHFFFAOYSA-K
MW345.70 g/mol
LogP4.20
Rot. Bonds

About 2-methylpropane;tribromotitanium

2-methylpropane;tribromotitanium (PubChem CID 174154914) has the molecular formula C4H10Br3Ti and a molecular weight of 345.70 g/mol. Its IUPAC name is 2-methylpropane;tribromotitanium.

Molecular Properties

Compound Name2-methylpropane;tribromotitanium
PubChem CID174154914
Molecular FormulaC4H10Br3Ti
Molecular Weight345.70 g/mol
Exact Mass342.78
IUPAC Name2-methylpropane;tribromotitanium
SMILESBr[Ti](Br)Br.CC(C)C
InChIInChI=1S/C4H10.3BrH.Ti/c1-4(2)3;;;;/h4H,1-3H3;3*1H;/q;;;;+3/p-3
InChIKeyWLDNPFBWHQWZJO-UHFFFAOYSA-K
XLogP4.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.70
LogP ≤ 54.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-methylpropane;tribromotitanium?
The IUPAC name of 2-methylpropane;tribromotitanium (CID 174154914) is 2-methylpropane;tribromotitanium.
What is the SMILES notation for 2-methylpropane;tribromotitanium?
The canonical SMILES for 2-methylpropane;tribromotitanium is Br[Ti](Br)Br.CC(C)C.
What is the InChIKey of 2-methylpropane;tribromotitanium?
The InChIKey is WLDNPFBWHQWZJO-UHFFFAOYSA-K. The full InChI is InChI=1S/C4H10.3BrH.Ti/c1-4(2)3;;;;/h4H,1-3H3;3*1H;/q;;;;+3/p-3.
What are the key properties of 2-methylpropane;tribromotitanium?
2-methylpropane;tribromotitanium has a molecular weight of 345.70 g/mol, XLogP of 4.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpropane;tribromotitanium is sourced from PubChem (CID 174154914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).