triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane

C26H40O2Si2 — CID 122396412

IUPACtriethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane
SMILESC=CCCCCC(C)O[Si](O[Si](CC)(CC)CC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H40O2Si2/c1-6-10-11-14-19-24(5)27-30(25-20-15-12-16-21-25,26-22-17-13-18-23-26)28-29(7-2,8-3)9-4/h6,12-13,15-18,20-24H,1,7-11,14,19H2,2-5H3
InChIKeySRLCRQHZXWNWAN-UHFFFAOYSA-N
MW440.78 g/mol
LogP6.42
Rot. Bonds14

About triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane

triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane (PubChem CID 122396412) has the molecular formula C26H40O2Si2 and a molecular weight of 440.78 g/mol. Its IUPAC name is triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane.

Molecular Properties

Compound Nametriethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane
PubChem CID122396412
Molecular FormulaC26H40O2Si2
Molecular Weight440.78 g/mol
Exact Mass440.26
IUPAC Nametriethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane
SMILESC=CCCCCC(C)O[Si](O[Si](CC)(CC)CC)(c1ccccc1)c1ccccc1
InChIInChI=1S/C26H40O2Si2/c1-6-10-11-14-19-24(5)27-30(25-20-15-12-16-21-25,26-22-17-13-18-23-26)28-29(7-2,8-3)9-4/h6,12-13,15-18,20-24H,1,7-11,14,19H2,2-5H3
InChIKeySRLCRQHZXWNWAN-UHFFFAOYSA-N
XLogP6.42
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds14
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500440.78
LogP ≤ 56.42
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'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane?
The IUPAC name of triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane (CID 122396412) is triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane.
What is the SMILES notation for triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane?
The canonical SMILES for triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane is C=CCCCCC(C)O[Si](O[Si](CC)(CC)CC)(c1ccccc1)c1ccccc1.
What is the InChIKey of triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane?
The InChIKey is SRLCRQHZXWNWAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H40O2Si2/c1-6-10-11-14-19-24(5)27-30(25-20-15-12-16-21-25,26-22-17-13-18-23-26)28-29(7-2,8-3)9-4/h6,12-13,15-18,20-24H,1,7-11,14,19H2,2-5H3.
What are the key properties of triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane?
triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane has a molecular weight of 440.78 g/mol, XLogP of 6.42, 14 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-[oct-7-en-2-yloxy(diphenyl)silyl]oxysilane is sourced from PubChem (CID 122396412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).