ethenyl-methyl-di(pentan-3-yl)silane

C13H28Si — CID 54079246

IUPACethenyl-methyl-di(pentan-3-yl)silane
SMILESC=C[Si](C)(C(CC)CC)C(CC)CC
InChIInChI=1S/C13H28Si/c1-7-12(8-2)14(6,11-5)13(9-3)10-4/h11-13H,5,7-10H2,1-4,6H3
InChIKeyMLXAQOAACNJUAZ-UHFFFAOYSA-N
MW212.45 g/mol
LogP5.17
Rot. Bonds7

About ethenyl-methyl-di(pentan-3-yl)silane

ethenyl-methyl-di(pentan-3-yl)silane (PubChem CID 54079246) has the molecular formula C13H28Si and a molecular weight of 212.45 g/mol. Its IUPAC name is ethenyl-methyl-di(pentan-3-yl)silane.

Molecular Properties

Compound Nameethenyl-methyl-di(pentan-3-yl)silane
PubChem CID54079246
Molecular FormulaC13H28Si
Molecular Weight212.45 g/mol
Exact Mass212.20
IUPAC Nameethenyl-methyl-di(pentan-3-yl)silane
SMILESC=C[Si](C)(C(CC)CC)C(CC)CC
InChIInChI=1S/C13H28Si/c1-7-12(8-2)14(6,11-5)13(9-3)10-4/h11-13H,5,7-10H2,1-4,6H3
InChIKeyMLXAQOAACNJUAZ-UHFFFAOYSA-N
XLogP5.17
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms14
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500212.45
LogP ≤ 55.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-di(pentan-3-yl)silane?
The IUPAC name of ethenyl-methyl-di(pentan-3-yl)silane (CID 54079246) is ethenyl-methyl-di(pentan-3-yl)silane.
What is the SMILES notation for ethenyl-methyl-di(pentan-3-yl)silane?
The canonical SMILES for ethenyl-methyl-di(pentan-3-yl)silane is C=C[Si](C)(C(CC)CC)C(CC)CC.
What is the InChIKey of ethenyl-methyl-di(pentan-3-yl)silane?
The InChIKey is MLXAQOAACNJUAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28Si/c1-7-12(8-2)14(6,11-5)13(9-3)10-4/h11-13H,5,7-10H2,1-4,6H3.
What are the key properties of ethenyl-methyl-di(pentan-3-yl)silane?
ethenyl-methyl-di(pentan-3-yl)silane has a molecular weight of 212.45 g/mol, XLogP of 5.17, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-di(pentan-3-yl)silane is sourced from PubChem (CID 54079246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).