ethenyl-heptan-4-yloxy-methyl-propoxysilane

C13H28O2Si — CID 91733088

IUPACethenyl-heptan-4-yloxy-methyl-propoxysilane
SMILESC=C[Si](C)(OCCC)OC(CCC)CCC
InChIInChI=1S/C13H28O2Si/c1-6-10-13(11-7-2)15-16(5,9-4)14-12-8-3/h9,13H,4,6-8,10-12H2,1-3,5H3
InChIKeyQJFVGNRJTIQONJ-UHFFFAOYSA-N
MW244.45 g/mol
LogP4.20
Rot. Bonds10

About ethenyl-heptan-4-yloxy-methyl-propoxysilane

ethenyl-heptan-4-yloxy-methyl-propoxysilane (PubChem CID 91733088) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is ethenyl-heptan-4-yloxy-methyl-propoxysilane.

Molecular Properties

Compound Nameethenyl-heptan-4-yloxy-methyl-propoxysilane
PubChem CID91733088
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nameethenyl-heptan-4-yloxy-methyl-propoxysilane
SMILESC=C[Si](C)(OCCC)OC(CCC)CCC
InChIInChI=1S/C13H28O2Si/c1-6-10-13(11-7-2)15-16(5,9-4)14-12-8-3/h9,13H,4,6-8,10-12H2,1-3,5H3
InChIKeyQJFVGNRJTIQONJ-UHFFFAOYSA-N
XLogP4.20
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
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': 'heavy_metal', 'substructure': 'N/A'}

Analyze ethenyl-heptan-4-yloxy-methyl-propoxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Silane, methylvinyl(oct-4-yloxy)isopropoxy-
CID 91699097
Silane, diethylbutoxy(3-heptyloxy)-
CID 91719426
Silane, monochloride, methylvinyl(hept-2-yloxy)-
CID 91720331
Silane, methylvinyl(pent-2-yloxy)ethoxy-
CID 91723233
Silane, methylvinyl(oct-2-yloxy)ethoxy-
CID 91723234
Silane, methylvinyl(pent-2-yloxy)propoxy-
CID 91726227
Silane, methylvinyl(oct-2-yloxy)propoxy-
CID 91726228
Silane, methylvinyl(pent-2-yloxy)isopropoxy-
CID 91726393
Silane, methylvinyl(pent-2-yloxy)(methylvinyl(pent-2-yloxy)silyloxy)-
CID 91726489
Silane, methylvinyl(hept-4-yloxy)(methylvinyl(hept-4-yloxy)silyloxy)-
CID 91726528
Silane, methylvinyl(oct-4-yloxy)(methylvinyl(oct-4-yloxy)silyloxy)-
CID 91726540
Silane, methylvinyl(pent-2-yloxy)isobutoxy-
CID 91730036

Frequently Asked Questions

What is the IUPAC name of ethenyl-heptan-4-yloxy-methyl-propoxysilane?
The IUPAC name of ethenyl-heptan-4-yloxy-methyl-propoxysilane (CID 91733088) is ethenyl-heptan-4-yloxy-methyl-propoxysilane.
What is the SMILES notation for ethenyl-heptan-4-yloxy-methyl-propoxysilane?
The canonical SMILES for ethenyl-heptan-4-yloxy-methyl-propoxysilane is C=C[Si](C)(OCCC)OC(CCC)CCC.
What is the InChIKey of ethenyl-heptan-4-yloxy-methyl-propoxysilane?
The InChIKey is QJFVGNRJTIQONJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-6-10-13(11-7-2)15-16(5,9-4)14-12-8-3/h9,13H,4,6-8,10-12H2,1-3,5H3.
What are the key properties of ethenyl-heptan-4-yloxy-methyl-propoxysilane?
ethenyl-heptan-4-yloxy-methyl-propoxysilane has a molecular weight of 244.45 g/mol, XLogP of 4.20, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-heptan-4-yloxy-methyl-propoxysilane is sourced from PubChem (CID 91733088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).