diethoxy-bis(2-methylpentyl)silane

C16H36O2Si — CID 178181643

IUPACdiethoxy-bis(2-methylpentyl)silane
SMILESCCCC(C)C[Si](CC(C)CCC)(OCC)OCC
InChIInChI=1S/C16H36O2Si/c1-7-11-15(5)13-19(17-9-3,18-10-4)14-16(6)12-8-2/h15-16H,7-14H2,1-6H3
InChIKeyAESFXDLGIASHPF-UHFFFAOYSA-N
MW288.55 g/mol
LogP5.37
Rot. Bonds12

About diethoxy-bis(2-methylpentyl)silane

diethoxy-bis(2-methylpentyl)silane (PubChem CID 178181643) has the molecular formula C16H36O2Si and a molecular weight of 288.55 g/mol. Its IUPAC name is diethoxy-bis(2-methylpentyl)silane.

Molecular Properties

Compound Namediethoxy-bis(2-methylpentyl)silane
PubChem CID178181643
Molecular FormulaC16H36O2Si
Molecular Weight288.55 g/mol
Exact Mass288.25
IUPAC Namediethoxy-bis(2-methylpentyl)silane
SMILESCCCC(C)C[Si](CC(C)CCC)(OCC)OCC
InChIInChI=1S/C16H36O2Si/c1-7-11-15(5)13-19(17-9-3,18-10-4)14-16(6)12-8-2/h15-16H,7-14H2,1-6H3
InChIKeyAESFXDLGIASHPF-UHFFFAOYSA-N
XLogP5.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500288.55
LogP ≤ 55.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diethoxy-bis(2-methylpentyl)silane?
The IUPAC name of diethoxy-bis(2-methylpentyl)silane (CID 178181643) is diethoxy-bis(2-methylpentyl)silane.
What is the SMILES notation for diethoxy-bis(2-methylpentyl)silane?
The canonical SMILES for diethoxy-bis(2-methylpentyl)silane is CCCC(C)C[Si](CC(C)CCC)(OCC)OCC.
What is the InChIKey of diethoxy-bis(2-methylpentyl)silane?
The InChIKey is AESFXDLGIASHPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H36O2Si/c1-7-11-15(5)13-19(17-9-3,18-10-4)14-16(6)12-8-2/h15-16H,7-14H2,1-6H3.
What are the key properties of diethoxy-bis(2-methylpentyl)silane?
diethoxy-bis(2-methylpentyl)silane has a molecular weight of 288.55 g/mol, XLogP of 5.37, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-bis(2-methylpentyl)silane is sourced from PubChem (CID 178181643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).