hexyl-dimethoxy-(2-methylpropyl)silane

C12H28O2Si — CID 18006020

IUPAChexyl-dimethoxy-(2-methylpropyl)silane
SMILESCCCCCC[Si](CC(C)C)(OC)OC
InChIInChI=1S/C12H28O2Si/c1-6-7-8-9-10-15(13-4,14-5)11-12(2)3/h12H,6-11H2,1-5H3
InChIKeyKYOCSBMTZUXCAW-UHFFFAOYSA-N
MW232.44 g/mol
LogP3.96
Rot. Bonds9

About hexyl-dimethoxy-(2-methylpropyl)silane

hexyl-dimethoxy-(2-methylpropyl)silane (PubChem CID 18006020) has the molecular formula C12H28O2Si and a molecular weight of 232.44 g/mol. Its IUPAC name is hexyl-dimethoxy-(2-methylpropyl)silane.

Molecular Properties

Compound Namehexyl-dimethoxy-(2-methylpropyl)silane
PubChem CID18006020
Molecular FormulaC12H28O2Si
Molecular Weight232.44 g/mol
Exact Mass232.19
IUPAC Namehexyl-dimethoxy-(2-methylpropyl)silane
SMILESCCCCCC[Si](CC(C)C)(OC)OC
InChIInChI=1S/C12H28O2Si/c1-6-7-8-9-10-15(13-4,14-5)11-12(2)3/h12H,6-11H2,1-5H3
InChIKeyKYOCSBMTZUXCAW-UHFFFAOYSA-N
XLogP3.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.44
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of hexyl-dimethoxy-(2-methylpropyl)silane?
The IUPAC name of hexyl-dimethoxy-(2-methylpropyl)silane (CID 18006020) is hexyl-dimethoxy-(2-methylpropyl)silane.
What is the SMILES notation for hexyl-dimethoxy-(2-methylpropyl)silane?
The canonical SMILES for hexyl-dimethoxy-(2-methylpropyl)silane is CCCCCC[Si](CC(C)C)(OC)OC.
What is the InChIKey of hexyl-dimethoxy-(2-methylpropyl)silane?
The InChIKey is KYOCSBMTZUXCAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O2Si/c1-6-7-8-9-10-15(13-4,14-5)11-12(2)3/h12H,6-11H2,1-5H3.
What are the key properties of hexyl-dimethoxy-(2-methylpropyl)silane?
hexyl-dimethoxy-(2-methylpropyl)silane has a molecular weight of 232.44 g/mol, XLogP of 3.96, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl-dimethoxy-(2-methylpropyl)silane is sourced from PubChem (CID 18006020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).