2-methylpentane;titanium(4+);tetrachloride

C6H14Cl4Ti — CID 158147790

IUPAC2-methylpentane;titanium(4+);tetrachloride
SMILESCCCC(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C6H14.4ClH.Ti/c1-4-5-6(2)3;;;;;/h6H,4-5H2,1-3H3;4*1H;/q;;;;;+4/p-4
InChIKeyFUSNVJPPLSNCJQ-UHFFFAOYSA-J
MW275.86 g/mol
LogP-9.54
Rot. Bonds2

About 2-methylpentane;titanium(4+);tetrachloride

2-methylpentane;titanium(4+);tetrachloride (PubChem CID 158147790) has the molecular formula C6H14Cl4Ti and a molecular weight of 275.86 g/mol. Its IUPAC name is 2-methylpentane;titanium(4+);tetrachloride.

Molecular Properties

Compound Name2-methylpentane;titanium(4+);tetrachloride
PubChem CID158147790
Molecular FormulaC6H14Cl4Ti
Molecular Weight275.86 g/mol
Exact Mass273.93
IUPAC Name2-methylpentane;titanium(4+);tetrachloride
SMILESCCCC(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4]
InChIInChI=1S/C6H14.4ClH.Ti/c1-4-5-6(2)3;;;;;/h6H,4-5H2,1-3H3;4*1H;/q;;;;;+4/p-4
InChIKeyFUSNVJPPLSNCJQ-UHFFFAOYSA-J
XLogP-9.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.86
LogP ≤ 5-9.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2-methylpentane
CID 7892
ethane;2-methylpentane
CID 143713716
azane;2-methylpentane
CID 18347292
2-methylpentane;hydroiodide
CID 160726714
azane;2-methylpentane
CID 87098569
ethane;methane;bis(2-methylpentane)
CID 142143156
methane;2-methylpentane;propane
CID 161026516
ethanamine;2-methylpentane
CID 143240474
hexane;2-methylpentane
CID 19835603
ethane;2-methylpentane;pentane;propane
CID 142044971
ethane;2-methylpentane;prop-1-yne
CID 143374502
2-methylpentane diisocyanate
CID 22323257

Frequently Asked Questions

What is the IUPAC name of 2-methylpentane;titanium(4+);tetrachloride?
The IUPAC name of 2-methylpentane;titanium(4+);tetrachloride (CID 158147790) is 2-methylpentane;titanium(4+);tetrachloride.
What is the SMILES notation for 2-methylpentane;titanium(4+);tetrachloride?
The canonical SMILES for 2-methylpentane;titanium(4+);tetrachloride is CCCC(C)C.[Cl-].[Cl-].[Cl-].[Cl-].[Ti+4].
What is the InChIKey of 2-methylpentane;titanium(4+);tetrachloride?
The InChIKey is FUSNVJPPLSNCJQ-UHFFFAOYSA-J. The full InChI is InChI=1S/C6H14.4ClH.Ti/c1-4-5-6(2)3;;;;;/h6H,4-5H2,1-3H3;4*1H;/q;;;;;+4/p-4.
What are the key properties of 2-methylpentane;titanium(4+);tetrachloride?
2-methylpentane;titanium(4+);tetrachloride has a molecular weight of 275.86 g/mol, XLogP of -9.54, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpentane;titanium(4+);tetrachloride is sourced from PubChem (CID 158147790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).