3,3-diethoxyhept-4-enylsilane

C11H24O2Si — CID 154282504

IUPAC3,3-diethoxyhept-4-enylsilane
SMILESCCC=CC(CC[SiH3])(OCC)OCC
InChIInChI=1S/C11H24O2Si/c1-4-7-8-11(9-10-14,12-5-2)13-6-3/h7-8H,4-6,9-10H2,1-3,14H3
InChIKeyZMAOMNFUXYHPKS-UHFFFAOYSA-N
MW216.40 g/mol
LogP1.90
Rot. Bonds8

About 3,3-diethoxyhept-4-enylsilane

3,3-diethoxyhept-4-enylsilane (PubChem CID 154282504) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is 3,3-diethoxyhept-4-enylsilane.

Molecular Properties

Compound Name3,3-diethoxyhept-4-enylsilane
PubChem CID154282504
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Name3,3-diethoxyhept-4-enylsilane
SMILESCCC=CC(CC[SiH3])(OCC)OCC
InChIInChI=1S/C11H24O2Si/c1-4-7-8-11(9-10-14,12-5-2)13-6-3/h7-8H,4-6,9-10H2,1-3,14H3
InChIKeyZMAOMNFUXYHPKS-UHFFFAOYSA-N
XLogP1.90
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 51.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3,3-diethoxyhept-4-enylsilane?
The IUPAC name of 3,3-diethoxyhept-4-enylsilane (CID 154282504) is 3,3-diethoxyhept-4-enylsilane.
What is the SMILES notation for 3,3-diethoxyhept-4-enylsilane?
The canonical SMILES for 3,3-diethoxyhept-4-enylsilane is CCC=CC(CC[SiH3])(OCC)OCC.
What is the InChIKey of 3,3-diethoxyhept-4-enylsilane?
The InChIKey is ZMAOMNFUXYHPKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2Si/c1-4-7-8-11(9-10-14,12-5-2)13-6-3/h7-8H,4-6,9-10H2,1-3,14H3.
What are the key properties of 3,3-diethoxyhept-4-enylsilane?
3,3-diethoxyhept-4-enylsilane has a molecular weight of 216.40 g/mol, XLogP of 1.90, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-diethoxyhept-4-enylsilane is sourced from PubChem (CID 154282504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).