1,1-dipentoxysilolane

C14H30O2Si — CID 608427

IUPAC1,1-dipentoxysilolane
SMILESCCCCCO[Si]1(OCCCCC)CCCC1
InChIInChI=1S/C14H30O2Si/c1-3-5-7-11-15-17(13-9-10-14-17)16-12-8-6-4-2/h3-14H2,1-2H3
InChIKeyKHDUXVLUWWFLEK-UHFFFAOYSA-N
MW258.48 g/mol
LogP4.64
Rot. Bonds10

About 1,1-dipentoxysilolane

1,1-dipentoxysilolane (PubChem CID 608427) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is 1,1-dipentoxysilolane.

Molecular Properties

Compound Name1,1-dipentoxysilolane
PubChem CID608427
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Name1,1-dipentoxysilolane
SMILESCCCCCO[Si]1(OCCCCC)CCCC1
InChIInChI=1S/C14H30O2Si/c1-3-5-7-11-15-17(13-9-10-14-17)16-12-8-6-4-2/h3-14H2,1-2H3
InChIKeyKHDUXVLUWWFLEK-UHFFFAOYSA-N
XLogP4.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.48
LogP ≤ 54.64
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 1,1-dipentoxysilolane?
The IUPAC name of 1,1-dipentoxysilolane (CID 608427) is 1,1-dipentoxysilolane.
What is the SMILES notation for 1,1-dipentoxysilolane?
The canonical SMILES for 1,1-dipentoxysilolane is CCCCCO[Si]1(OCCCCC)CCCC1.
What is the InChIKey of 1,1-dipentoxysilolane?
The InChIKey is KHDUXVLUWWFLEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-3-5-7-11-15-17(13-9-10-14-17)16-12-8-6-4-2/h3-14H2,1-2H3.
What are the key properties of 1,1-dipentoxysilolane?
1,1-dipentoxysilolane has a molecular weight of 258.48 g/mol, XLogP of 4.64, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dipentoxysilolane is sourced from PubChem (CID 608427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).