[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane

C25H51FOSiSn — CID 12801789

IUPAC[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
SMILESC=C(F)C(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCC)O[Si](C)(C)C
InChIInChI=1S/C13H24FOSi.3C4H9.Sn/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6;3*1-3-4-2;/h2,8H,3,7,9-11H2,1,4-6H3;3*1,3-4H2,2H3;
InChIKeyFUNJMIDPQBRAMQ-UHFFFAOYSA-N
MW533.48 g/mol
LogP9.58
Rot. Bonds18

About [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane

[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane (PubChem CID 12801789) has the molecular formula C25H51FOSiSn and a molecular weight of 533.48 g/mol. Its IUPAC name is [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
PubChem CID12801789
Molecular FormulaC25H51FOSiSn
Molecular Weight533.48 g/mol
Exact Mass534.27
IUPAC Name[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
SMILESC=C(F)C(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCC)O[Si](C)(C)C
InChIInChI=1S/C13H24FOSi.3C4H9.Sn/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6;3*1-3-4-2;/h2,8H,3,7,9-11H2,1,4-6H3;3*1,3-4H2,2H3;
InChIKeyFUNJMIDPQBRAMQ-UHFFFAOYSA-N
XLogP9.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds18
Heavy Atoms29
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500533.48
LogP ≤ 59.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane 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

4-Fluoromethyl-4-trimethylsilyloxy-1-tri-n-butylstannyl-trans-1-octene
CID 12786208
trans-4-Trifluoromethyl-4-trimethylsiloxy-1-tri n-butylstannyl-1-octene
CID 12786209
trans-4-Difluoromethyl-4-trimethylsiloxy-1-tri-n-butylstannyl-1-octene
CID 21587526
[4-(Difluoromethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
CID 73807161
[4-(Fluoromethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
CID 85444623
Trimethyl-[1-tributylstannyl-4-(trifluoromethyl)oct-1-en-4-yl]oxysilane
CID 85444624
CID 170852898
CID 170852898
Tributyl((1E)-4-methyl-4-((trimethylsilyl)oxy)-1-octen-1-yl)stannane
CID 12893763
Trimethyl{[4-methyl-1-(tributylstannyl)oct-1-en-4-yl]oxy}silane
CID 53426864
4-(1-Fluoroethenyl)oct-1-en-4-yloxy-trimethylsilane
CID 20563753
triethyl-[(E)-4-methyl-1-tributylstannyloct-1-en-4-yl]oxysilane
CID 11146006
[(E)-3-ethenyl-1-tributylstannyloct-1-en-3-yl]oxy-trimethylsilane
CID 12786168

Frequently Asked Questions

What is the IUPAC name of [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The IUPAC name of [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane (CID 12801789) is [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane.
What is the SMILES notation for [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The canonical SMILES for [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane is C=C(F)C(C/C=C/[Sn](CCCC)(CCCC)CCCC)(CCCC)O[Si](C)(C)C.
What is the InChIKey of [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The InChIKey is FUNJMIDPQBRAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24FOSi.3C4H9.Sn/c1-7-9-11-13(10-8-2,12(3)14)15-16(4,5)6;3*1-3-4-2;/h2,8H,3,7,9-11H2,1,4-6H3;3*1,3-4H2,2H3;.
What are the key properties of [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
[(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane has a molecular weight of 533.48 g/mol, XLogP of 9.58, 18 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-4-(1-fluoroethenyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane is sourced from PubChem (CID 12801789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).