ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane

C12H26O2Si — CID 91730036

IUPACethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane
SMILESC=C[Si](C)(OCC(C)C)OC(C)CCC
InChIInChI=1S/C12H26O2Si/c1-7-9-12(5)14-15(6,8-2)13-10-11(3)4/h8,11-12H,2,7,9-10H2,1,3-6H3
InChIKeyOSERZRLUWSWWKJ-UHFFFAOYSA-N
MW230.42 g/mol
LogP3.66
Rot. Bonds8

About ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane

ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane (PubChem CID 91730036) has the molecular formula C12H26O2Si and a molecular weight of 230.42 g/mol. Its IUPAC name is ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane.

Molecular Properties

Compound Nameethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane
PubChem CID91730036
Molecular FormulaC12H26O2Si
Molecular Weight230.42 g/mol
Exact Mass230.17
IUPAC Nameethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane
SMILESC=C[Si](C)(OCC(C)C)OC(C)CCC
InChIInChI=1S/C12H26O2Si/c1-7-9-12(5)14-15(6,8-2)13-10-11(3)4/h8,11-12H,2,7,9-10H2,1,3-6H3
InChIKeyOSERZRLUWSWWKJ-UHFFFAOYSA-N
XLogP3.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.42
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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-(2-methylpropoxy)-pentan-2-yloxysilane?
The IUPAC name of ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane (CID 91730036) is ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane.
What is the SMILES notation for ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane?
The canonical SMILES for ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane is C=C[Si](C)(OCC(C)C)OC(C)CCC.
What is the InChIKey of ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane?
The InChIKey is OSERZRLUWSWWKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26O2Si/c1-7-9-12(5)14-15(6,8-2)13-10-11(3)4/h8,11-12H,2,7,9-10H2,1,3-6H3.
What are the key properties of ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane?
ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane has a molecular weight of 230.42 g/mol, XLogP of 3.66, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-(2-methylpropoxy)-pentan-2-yloxysilane is sourced from PubChem (CID 91730036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).