dimethyl-bis(4-methylpentoxy)silane

C14H32O2Si — CID 91698398

IUPACdimethyl-bis(4-methylpentoxy)silane
SMILESCC(C)CCCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-13(2)9-7-11-15-17(5,6)16-12-8-10-14(3)4/h13-14H,7-12H2,1-6H3
InChIKeyKHCMERGXPGGNNY-UHFFFAOYSA-N
MW260.49 g/mol
LogP4.59
Rot. Bonds10

About dimethyl-bis(4-methylpentoxy)silane

dimethyl-bis(4-methylpentoxy)silane (PubChem CID 91698398) has the molecular formula C14H32O2Si and a molecular weight of 260.49 g/mol. Its IUPAC name is dimethyl-bis(4-methylpentoxy)silane.

Molecular Properties

Compound Namedimethyl-bis(4-methylpentoxy)silane
PubChem CID91698398
Molecular FormulaC14H32O2Si
Molecular Weight260.49 g/mol
Exact Mass260.22
IUPAC Namedimethyl-bis(4-methylpentoxy)silane
SMILESCC(C)CCCO[Si](C)(C)OCCCC(C)C
InChIInChI=1S/C14H32O2Si/c1-13(2)9-7-11-15-17(5,6)16-12-8-10-14(3)4/h13-14H,7-12H2,1-6H3
InChIKeyKHCMERGXPGGNNY-UHFFFAOYSA-N
XLogP4.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.49
LogP ≤ 54.59
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'}

Analyze dimethyl-bis(4-methylpentoxy)silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of dimethyl-bis(4-methylpentoxy)silane?
The IUPAC name of dimethyl-bis(4-methylpentoxy)silane (CID 91698398) is dimethyl-bis(4-methylpentoxy)silane.
What is the SMILES notation for dimethyl-bis(4-methylpentoxy)silane?
The canonical SMILES for dimethyl-bis(4-methylpentoxy)silane is CC(C)CCCO[Si](C)(C)OCCCC(C)C.
What is the InChIKey of dimethyl-bis(4-methylpentoxy)silane?
The InChIKey is KHCMERGXPGGNNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H32O2Si/c1-13(2)9-7-11-15-17(5,6)16-12-8-10-14(3)4/h13-14H,7-12H2,1-6H3.
What are the key properties of dimethyl-bis(4-methylpentoxy)silane?
dimethyl-bis(4-methylpentoxy)silane has a molecular weight of 260.49 g/mol, XLogP of 4.59, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-bis(4-methylpentoxy)silane is sourced from PubChem (CID 91698398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).