3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane

C13H24O4Si — CID 174838425

IUPAC3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane
SMILESC=CC1(C=C)CCC[Si](OC)(OC)C1(OC)OC
InChIInChI=1S/C13H24O4Si/c1-7-12(8-2)10-9-11-18(16-5,17-6)13(12,14-3)15-4/h7-8H,1-2,9-11H2,3-6H3
InChIKeyRYGCGBUDBYCANH-UHFFFAOYSA-N
MW272.42 g/mol
LogP2.40
Rot. Bonds6

About 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane

3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane (PubChem CID 174838425) has the molecular formula C13H24O4Si and a molecular weight of 272.42 g/mol. Its IUPAC name is 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane.

Molecular Properties

Compound Name3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane
PubChem CID174838425
Molecular FormulaC13H24O4Si
Molecular Weight272.42 g/mol
Exact Mass272.14
IUPAC Name3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane
SMILESC=CC1(C=C)CCC[Si](OC)(OC)C1(OC)OC
InChIInChI=1S/C13H24O4Si/c1-7-12(8-2)10-9-11-18(16-5,17-6)13(12,14-3)15-4/h7-8H,1-2,9-11H2,3-6H3
InChIKeyRYGCGBUDBYCANH-UHFFFAOYSA-N
XLogP2.40
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.42
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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-bis(ethenyl)-1,1,2,2-tetramethoxysilinane?
The IUPAC name of 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane (CID 174838425) is 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane.
What is the SMILES notation for 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane?
The canonical SMILES for 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane is C=CC1(C=C)CCC[Si](OC)(OC)C1(OC)OC.
What is the InChIKey of 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane?
The InChIKey is RYGCGBUDBYCANH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O4Si/c1-7-12(8-2)10-9-11-18(16-5,17-6)13(12,14-3)15-4/h7-8H,1-2,9-11H2,3-6H3.
What are the key properties of 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane?
3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane has a molecular weight of 272.42 g/mol, XLogP of 2.40, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-bis(ethenyl)-1,1,2,2-tetramethoxysilinane is sourced from PubChem (CID 174838425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).