trichloro(4-methylhexan-3-yl)silane

C7H15Cl3Si — CID 22129062

IUPACtrichloro(4-methylhexan-3-yl)silane
SMILESCCC(C)C(CC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H15Cl3Si/c1-4-6(3)7(5-2)11(8,9)10/h6-7H,4-5H2,1-3H3
InChIKeyNKIWRJNVORPAEI-UHFFFAOYSA-N
MW233.64 g/mol
LogP4.47
Rot. Bonds4

About trichloro(4-methylhexan-3-yl)silane

trichloro(4-methylhexan-3-yl)silane (PubChem CID 22129062) has the molecular formula C7H15Cl3Si and a molecular weight of 233.64 g/mol. Its IUPAC name is trichloro(4-methylhexan-3-yl)silane.

Molecular Properties

Compound Nametrichloro(4-methylhexan-3-yl)silane
PubChem CID22129062
Molecular FormulaC7H15Cl3Si
Molecular Weight233.64 g/mol
Exact Mass232.00
IUPAC Nametrichloro(4-methylhexan-3-yl)silane
SMILESCCC(C)C(CC)[Si](Cl)(Cl)Cl
InChIInChI=1S/C7H15Cl3Si/c1-4-6(3)7(5-2)11(8,9)10/h6-7H,4-5H2,1-3H3
InChIKeyNKIWRJNVORPAEI-UHFFFAOYSA-N
XLogP4.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.64
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trichloro(4-methylhexan-3-yl)silane?
The IUPAC name of trichloro(4-methylhexan-3-yl)silane (CID 22129062) is trichloro(4-methylhexan-3-yl)silane.
What is the SMILES notation for trichloro(4-methylhexan-3-yl)silane?
The canonical SMILES for trichloro(4-methylhexan-3-yl)silane is CCC(C)C(CC)[Si](Cl)(Cl)Cl.
What is the InChIKey of trichloro(4-methylhexan-3-yl)silane?
The InChIKey is NKIWRJNVORPAEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15Cl3Si/c1-4-6(3)7(5-2)11(8,9)10/h6-7H,4-5H2,1-3H3.
What are the key properties of trichloro(4-methylhexan-3-yl)silane?
trichloro(4-methylhexan-3-yl)silane has a molecular weight of 233.64 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trichloro(4-methylhexan-3-yl)silane is sourced from PubChem (CID 22129062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).