1,1,2-trimethoxypent-4-enylsilane

C8H18O3Si — CID 174620032

IUPAC1,1,2-trimethoxypent-4-enylsilane
SMILESC=CCC(OC)C([SiH3])(OC)OC
InChIInChI=1S/C8H18O3Si/c1-5-6-7(9-2)8(12,10-3)11-4/h5,7H,1,6H2,2-4,12H3
InChIKeyNDXFNKYFZUALQV-UHFFFAOYSA-N
MW190.31 g/mol
LogP-0.11
Rot. Bonds6

About 1,1,2-trimethoxypent-4-enylsilane

1,1,2-trimethoxypent-4-enylsilane (PubChem CID 174620032) has the molecular formula C8H18O3Si and a molecular weight of 190.31 g/mol. Its IUPAC name is 1,1,2-trimethoxypent-4-enylsilane.

Molecular Properties

Compound Name1,1,2-trimethoxypent-4-enylsilane
PubChem CID174620032
Molecular FormulaC8H18O3Si
Molecular Weight190.31 g/mol
Exact Mass190.10
IUPAC Name1,1,2-trimethoxypent-4-enylsilane
SMILESC=CCC(OC)C([SiH3])(OC)OC
InChIInChI=1S/C8H18O3Si/c1-5-6-7(9-2)8(12,10-3)11-4/h5,7H,1,6H2,2-4,12H3
InChIKeyNDXFNKYFZUALQV-UHFFFAOYSA-N
XLogP-0.11
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.31
LogP ≤ 5-0.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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 1,1,2-trimethoxypent-4-enylsilane?
The IUPAC name of 1,1,2-trimethoxypent-4-enylsilane (CID 174620032) is 1,1,2-trimethoxypent-4-enylsilane.
What is the SMILES notation for 1,1,2-trimethoxypent-4-enylsilane?
The canonical SMILES for 1,1,2-trimethoxypent-4-enylsilane is C=CCC(OC)C([SiH3])(OC)OC.
What is the InChIKey of 1,1,2-trimethoxypent-4-enylsilane?
The InChIKey is NDXFNKYFZUALQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3Si/c1-5-6-7(9-2)8(12,10-3)11-4/h5,7H,1,6H2,2-4,12H3.
What are the key properties of 1,1,2-trimethoxypent-4-enylsilane?
1,1,2-trimethoxypent-4-enylsilane has a molecular weight of 190.31 g/mol, XLogP of -0.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,2-trimethoxypent-4-enylsilane is sourced from PubChem (CID 174620032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).