triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane

C16H36O6Si2 — CID 87100565

IUPACtriethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane
SMILESCCO[Si](C/C=C/C[Si](OCC)(OCC)OCC)(OCC)OCC
InChIInChI=1S/C16H36O6Si2/c1-7-17-23(18-8-2,19-9-3)15-13-14-16-24(20-10-4,21-11-5)22-12-6/h13-14H,7-12,15-16H2,1-6H3/b14-13+
InChIKeyCBANRTXDEZYLFH-BUHFOSPRSA-N
MW380.63 g/mol
LogP3.64
Rot. Bonds16

About triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane

triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane (PubChem CID 87100565) has the molecular formula C16H36O6Si2 and a molecular weight of 380.63 g/mol. Its IUPAC name is triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane.

Molecular Properties

Compound Nametriethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane
PubChem CID87100565
Molecular FormulaC16H36O6Si2
Molecular Weight380.63 g/mol
Exact Mass380.21
IUPAC Nametriethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane
SMILESCCO[Si](C/C=C/C[Si](OCC)(OCC)OCC)(OCC)OCC
InChIInChI=1S/C16H36O6Si2/c1-7-17-23(18-8-2,19-9-3)15-13-14-16-24(20-10-4,21-11-5)22-12-6/h13-14H,7-12,15-16H2,1-6H3/b14-13+
InChIKeyCBANRTXDEZYLFH-BUHFOSPRSA-N
XLogP3.64
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds16
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.63
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane?
The IUPAC name of triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane (CID 87100565) is triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane.
What is the SMILES notation for triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane?
The canonical SMILES for triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane is CCO[Si](C/C=C/C[Si](OCC)(OCC)OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane?
The InChIKey is CBANRTXDEZYLFH-BUHFOSPRSA-N. The full InChI is InChI=1S/C16H36O6Si2/c1-7-17-23(18-8-2,19-9-3)15-13-14-16-24(20-10-4,21-11-5)22-12-6/h13-14H,7-12,15-16H2,1-6H3/b14-13+.
What are the key properties of triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane?
triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane has a molecular weight of 380.63 g/mol, XLogP of 3.64, 16 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[(E)-4-triethoxysilylbut-2-enyl]silane is sourced from PubChem (CID 87100565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).