dimethoxy-octyl-pentylsilane

C15H34O2Si — CID 139614094

IUPACdimethoxy-octyl-pentylsilane
SMILESCCCCCCCC[Si](CCCCC)(OC)OC
InChIInChI=1S/C15H34O2Si/c1-5-7-9-10-11-13-15-18(16-3,17-4)14-12-8-6-2/h5-15H2,1-4H3
InChIKeyUDHSLMPGOOFJCR-UHFFFAOYSA-N
MW274.52 g/mol
LogP5.27
Rot. Bonds13

About dimethoxy-octyl-pentylsilane

dimethoxy-octyl-pentylsilane (PubChem CID 139614094) has the molecular formula C15H34O2Si and a molecular weight of 274.52 g/mol. Its IUPAC name is dimethoxy-octyl-pentylsilane.

Molecular Properties

Compound Namedimethoxy-octyl-pentylsilane
PubChem CID139614094
Molecular FormulaC15H34O2Si
Molecular Weight274.52 g/mol
Exact Mass274.23
IUPAC Namedimethoxy-octyl-pentylsilane
SMILESCCCCCCCC[Si](CCCCC)(OC)OC
InChIInChI=1S/C15H34O2Si/c1-5-7-9-10-11-13-15-18(16-3,17-4)14-12-8-6-2/h5-15H2,1-4H3
InChIKeyUDHSLMPGOOFJCR-UHFFFAOYSA-N
XLogP5.27
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms18
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.52
LogP ≤ 55.27
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 dimethoxy-octyl-pentylsilane?
The IUPAC name of dimethoxy-octyl-pentylsilane (CID 139614094) is dimethoxy-octyl-pentylsilane.
What is the SMILES notation for dimethoxy-octyl-pentylsilane?
The canonical SMILES for dimethoxy-octyl-pentylsilane is CCCCCCCC[Si](CCCCC)(OC)OC.
What is the InChIKey of dimethoxy-octyl-pentylsilane?
The InChIKey is UDHSLMPGOOFJCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34O2Si/c1-5-7-9-10-11-13-15-18(16-3,17-4)14-12-8-6-2/h5-15H2,1-4H3.
What are the key properties of dimethoxy-octyl-pentylsilane?
dimethoxy-octyl-pentylsilane has a molecular weight of 274.52 g/mol, XLogP of 5.27, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dimethoxy-octyl-pentylsilane is sourced from PubChem (CID 139614094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).