hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane

C12H28O3Si — CID 11043114

IUPAChexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane
SMILESCCCCCC[Si](OC)(OC)OC(C)(C)C
InChIInChI=1S/C12H28O3Si/c1-7-8-9-10-11-16(13-5,14-6)15-12(2,3)4/h7-11H2,1-6H3
InChIKeyMEVGNAVAUJTROT-UHFFFAOYSA-N
MW248.44 g/mol
LogP3.61
Rot. Bonds8

About hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane

hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane (PubChem CID 11043114) has the molecular formula C12H28O3Si and a molecular weight of 248.44 g/mol. Its IUPAC name is hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane.

Molecular Properties

Compound Namehexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane
PubChem CID11043114
Molecular FormulaC12H28O3Si
Molecular Weight248.44 g/mol
Exact Mass248.18
IUPAC Namehexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane
SMILESCCCCCC[Si](OC)(OC)OC(C)(C)C
InChIInChI=1S/C12H28O3Si/c1-7-8-9-10-11-16(13-5,14-6)15-12(2,3)4/h7-11H2,1-6H3
InChIKeyMEVGNAVAUJTROT-UHFFFAOYSA-N
XLogP3.61
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-methylpropan-2-yl)oxy]silane?
The IUPAC name of hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane (CID 11043114) is hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane is CCCCCC[Si](OC)(OC)OC(C)(C)C.
What is the InChIKey of hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is MEVGNAVAUJTROT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28O3Si/c1-7-8-9-10-11-16(13-5,14-6)15-12(2,3)4/h7-11H2,1-6H3.
What are the key properties of hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane?
hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 248.44 g/mol, XLogP of 3.61, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for hexyl-dimethoxy-[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 11043114), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).