ethenyl-methyl-dipentoxysilane

C13H28O2Si — CID 71381989

IUPACethenyl-methyl-dipentoxysilane
SMILESC=C[Si](C)(OCCCCC)OCCCCC
InChIInChI=1S/C13H28O2Si/c1-5-8-10-12-14-16(4,7-3)15-13-11-9-6-2/h7H,3,5-6,8-13H2,1-2,4H3
InChIKeyHLBWJVRSDTZITO-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.20
Rot. Bonds11

About ethenyl-methyl-dipentoxysilane

ethenyl-methyl-dipentoxysilane (PubChem CID 71381989) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is ethenyl-methyl-dipentoxysilane.

Molecular Properties

Compound Nameethenyl-methyl-dipentoxysilane
PubChem CID71381989
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nameethenyl-methyl-dipentoxysilane
SMILESC=C[Si](C)(OCCCCC)OCCCCC
InChIInChI=1S/C13H28O2Si/c1-5-8-10-12-14-16(4,7-3)15-13-11-9-6-2/h7H,3,5-6,8-13H2,1-2,4H3
InChIKeyHLBWJVRSDTZITO-UHFFFAOYSA-N
XLogP4.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.20
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'}

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Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-dipentoxysilane?
The IUPAC name of ethenyl-methyl-dipentoxysilane (CID 71381989) is ethenyl-methyl-dipentoxysilane.
What is the SMILES notation for ethenyl-methyl-dipentoxysilane?
The canonical SMILES for ethenyl-methyl-dipentoxysilane is C=C[Si](C)(OCCCCC)OCCCCC.
What is the InChIKey of ethenyl-methyl-dipentoxysilane?
The InChIKey is HLBWJVRSDTZITO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-5-8-10-12-14-16(4,7-3)15-13-11-9-6-2/h7H,3,5-6,8-13H2,1-2,4H3.
What are the key properties of ethenyl-methyl-dipentoxysilane?
ethenyl-methyl-dipentoxysilane has a molecular weight of 244.45 g/mol, XLogP of 4.20, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-dipentoxysilane is sourced from PubChem (CID 71381989), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).