1,1-diethoxyhex-5-enylsilane

C10H22O2Si — CID 173198573

IUPAC1,1-diethoxyhex-5-enylsilane
SMILESC=CCCCC([SiH3])(OCC)OCC
InChIInChI=1S/C10H22O2Si/c1-4-7-8-9-10(13,11-5-2)12-6-3/h4H,1,5-9H2,2-3,13H3
InChIKeyURNKDMUCSKECNO-UHFFFAOYSA-N
MW202.37 g/mol
LogP1.43
Rot. Bonds8

About 1,1-diethoxyhex-5-enylsilane

1,1-diethoxyhex-5-enylsilane (PubChem CID 173198573) has the molecular formula C10H22O2Si and a molecular weight of 202.37 g/mol. Its IUPAC name is 1,1-diethoxyhex-5-enylsilane.

Molecular Properties

Compound Name1,1-diethoxyhex-5-enylsilane
PubChem CID173198573
Molecular FormulaC10H22O2Si
Molecular Weight202.37 g/mol
Exact Mass202.14
IUPAC Name1,1-diethoxyhex-5-enylsilane
SMILESC=CCCCC([SiH3])(OCC)OCC
InChIInChI=1S/C10H22O2Si/c1-4-7-8-9-10(13,11-5-2)12-6-3/h4H,1,5-9H2,2-3,13H3
InChIKeyURNKDMUCSKECNO-UHFFFAOYSA-N
XLogP1.43
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.37
LogP ≤ 51.43
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'}, {'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 1,1-diethoxyhex-5-enylsilane?
The IUPAC name of 1,1-diethoxyhex-5-enylsilane (CID 173198573) is 1,1-diethoxyhex-5-enylsilane.
What is the SMILES notation for 1,1-diethoxyhex-5-enylsilane?
The canonical SMILES for 1,1-diethoxyhex-5-enylsilane is C=CCCCC([SiH3])(OCC)OCC.
What is the InChIKey of 1,1-diethoxyhex-5-enylsilane?
The InChIKey is URNKDMUCSKECNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O2Si/c1-4-7-8-9-10(13,11-5-2)12-6-3/h4H,1,5-9H2,2-3,13H3.
What are the key properties of 1,1-diethoxyhex-5-enylsilane?
1,1-diethoxyhex-5-enylsilane has a molecular weight of 202.37 g/mol, XLogP of 1.43, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-diethoxyhex-5-enylsilane is sourced from PubChem (CID 173198573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).