trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane

C24H50OSiSn — CID 12786234

IUPACtrimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane
SMILESC=CCCC(C)(C/C=C/[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C
InChIInChI=1S/C12H23OSi.3C4H9.Sn/c1-7-9-11-12(3,10-8-2)13-14(4,5)6;3*1-3-4-2;/h2,7-8H,1,9-11H2,3-6H3;3*1,3-4H2,2H3;
InChIKeyGYVBKRSCFCJLHV-UHFFFAOYSA-N
MW501.46 g/mol
LogP8.90
Rot. Bonds17

About trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane

trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane (PubChem CID 12786234) has the molecular formula C24H50OSiSn and a molecular weight of 501.46 g/mol. Its IUPAC name is trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane
PubChem CID12786234
Molecular FormulaC24H50OSiSn
Molecular Weight501.46 g/mol
Exact Mass502.27
IUPAC Nametrimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane
SMILESC=CCCC(C)(C/C=C/[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C
InChIInChI=1S/C12H23OSi.3C4H9.Sn/c1-7-9-11-12(3,10-8-2)13-14(4,5)6;3*1-3-4-2;/h2,7-8H,1,9-11H2,3-6H3;3*1,3-4H2,2H3;
InChIKeyGYVBKRSCFCJLHV-UHFFFAOYSA-N
XLogP8.90
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds17
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500501.46
LogP ≤ 58.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane?
The IUPAC name of trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane (CID 12786234) is trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane.
What is the SMILES notation for trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane?
The canonical SMILES for trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane is C=CCCC(C)(C/C=C/[Sn](CCCC)(CCCC)CCCC)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane?
The InChIKey is GYVBKRSCFCJLHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23OSi.3C4H9.Sn/c1-7-9-11-12(3,10-8-2)13-14(4,5)6;3*1-3-4-2;/h2,7-8H,1,9-11H2,3-6H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane?
trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane has a molecular weight of 501.46 g/mol, XLogP of 8.90, 17 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1E)-4-methyl-1-tributylstannylocta-1,7-dien-4-yl]oxysilane is sourced from PubChem (CID 12786234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).