ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane

C26H54O2Si — CID 91693706

IUPACethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane
SMILESC=C[Si](C)(OCCCCCCCCCCCCCCC)OCC(C)CC(C)(C)C
InChIInChI=1S/C26H54O2Si/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-27-29(7,9-2)28-24-25(3)23-26(4,5)6/h9,25H,2,8,10-24H2,1,3-7H3
InChIKeyOCZXFFLTYURZBP-UHFFFAOYSA-N
MW426.80 g/mol
LogP8.98
Rot. Bonds20

About ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane

ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane (PubChem CID 91693706) has the molecular formula C26H54O2Si and a molecular weight of 426.80 g/mol. Its IUPAC name is ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane.

Molecular Properties

Compound Nameethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane
PubChem CID91693706
Molecular FormulaC26H54O2Si
Molecular Weight426.80 g/mol
Exact Mass426.39
IUPAC Nameethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane
SMILESC=C[Si](C)(OCCCCCCCCCCCCCCC)OCC(C)CC(C)(C)C
InChIInChI=1S/C26H54O2Si/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-27-29(7,9-2)28-24-25(3)23-26(4,5)6/h9,25H,2,8,10-24H2,1,3-7H3
InChIKeyOCZXFFLTYURZBP-UHFFFAOYSA-N
XLogP8.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.80
LogP ≤ 58.98
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'}

Analyze ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane 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(octyloxy)octyloxy-
CID 23105081
Silane, methylvinyldi(2-ethylhexyloxy)-
CID 23213487
Silane, methylvinyl(dodecyloxy)dodecyloxy-
CID 87770809
Silane, methylvinyl(2,4,4-trimethylpentyloxy)tetradecyloxy-
CID 91693701
Silane, methylvinyl(2,4,4-trimethylpentyloxy)hexadecyloxy-
CID 91693712
Silane, methylvinyldi(3,7-dimethyloctyloxy)-
CID 91698190
Silane, methylvinyl(3,7-dimethyloctyloxy)isobutoxy-
CID 91698410
Silane, methylvinyl(3,7-dimethyloctyloxy)butoxy-
CID 91698411
Silane, methylvinyl(2,4,4-trimethylpentyloxy)isobutoxy-
CID 91726236
Silane, methylvinyl(2,4,4-trimethylpentyloxy)butoxy-
CID 91726237
Silane, methylvinyl(2,4,4-trimethylpentyloxy)(methylvinyl(2,4,4-trimethylpentyloxy)silyloxy)-
CID 91726539
Silane, methylvinyl(isobutoxy)(methylvinylundecyloxysilyloxy)-
CID 91726659

Frequently Asked Questions

What is the IUPAC name of ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane?
The IUPAC name of ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane (CID 91693706) is ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane.
What is the SMILES notation for ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane?
The canonical SMILES for ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane is C=C[Si](C)(OCCCCCCCCCCCCCCC)OCC(C)CC(C)(C)C.
What is the InChIKey of ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane?
The InChIKey is OCZXFFLTYURZBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H54O2Si/c1-8-10-11-12-13-14-15-16-17-18-19-20-21-22-27-29(7,9-2)28-24-25(3)23-26(4,5)6/h9,25H,2,8,10-24H2,1,3-7H3.
What are the key properties of ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane?
ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane has a molecular weight of 426.80 g/mol, XLogP of 8.98, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethenyl-methyl-pentadecoxy-(2,4,4-trimethylpentoxy)silane is sourced from PubChem (CID 91693706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).