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

C26H56O3SiSn — CID 12786207

IUPAC[(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
SMILESCCCCC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(O[Si](C)(C)C)C(OC)OC
InChIInChI=1S/C14H29O3Si.3C4H9.Sn/c1-8-10-12-14(11-9-2,13(15-3)16-4)17-18(5,6)7;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;
InChIKeyQWVSNVFEJDWSPC-UHFFFAOYSA-N
MW563.53 g/mol
LogP8.72
Rot. Bonds20

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

[(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane (PubChem CID 12786207) has the molecular formula C26H56O3SiSn and a molecular weight of 563.53 g/mol. Its IUPAC name is [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane.

Molecular Properties

Compound Name[(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
PubChem CID12786207
Molecular FormulaC26H56O3SiSn
Molecular Weight563.53 g/mol
Exact Mass564.30
IUPAC Name[(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane
SMILESCCCCC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(O[Si](C)(C)C)C(OC)OC
InChIInChI=1S/C14H29O3Si.3C4H9.Sn/c1-8-10-12-14(11-9-2,13(15-3)16-4)17-18(5,6)7;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;
InChIKeyQWVSNVFEJDWSPC-UHFFFAOYSA-N
XLogP8.72
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds20
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500563.53
LogP ≤ 58.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze [(E)-4-(dimethoxymethyl)-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

trimethyl-[(1E,5E)-4-methyl-1-tributylstannylocta-1,5-dien-4-yl]oxysilane
CID 23331458
(4S)-4-methyl-1-tributylstannyloct-1-en-4-ol
CID 173361577
(E,4S)-4-methyl-1-tributylstannyloct-1-en-4-ol
CID 14248080
ethenylstannane;5-methyl-8-tributylstannyl-5-trimethylsilyloxyoct-7-ene-2-sulfonic acid
CID 173440768
tributyl-[(Z)-2-tributylstannylethenyl]stannane
CID 12858946
trimethyl-[(Z)-2-tributylstannylethenyl]silane
CID 12516692
(E)-3-tributylstannylprop-2-en-1-amine
CID 45040600
tributyl-[(E)-4,4-diethoxybut-1-enyl]stannane
CID 10574786
trimethyl-[(E)-1-tributylstannyloct-1-en-3-yl]oxysilane
CID 19846630
dimethyl 2-[(E)-3-tributylstannylprop-2-enyl]propanedioate
CID 177384195
tert-butyl-[(E,3S)-4,4-difluoro-1-tributylstannyloct-1-en-3-yl]oxy-dimethylsilane
CID 87758729
trimethyl-[(Z)-5-methylnon-2-en-5-yl]oxysilane
CID 161469937

Frequently Asked Questions

What is the IUPAC name of [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The IUPAC name of [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane (CID 12786207) is [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane.
What is the SMILES notation for [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The canonical SMILES for [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane is CCCCC(C/C=C/[Sn](CCCC)(CCCC)CCCC)(O[Si](C)(C)C)C(OC)OC.
What is the InChIKey of [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
The InChIKey is QWVSNVFEJDWSPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29O3Si.3C4H9.Sn/c1-8-10-12-14(11-9-2,13(15-3)16-4)17-18(5,6)7;3*1-3-4-2;/h2,9,13H,8,10-12H2,1,3-7H3;3*1,3-4H2,2H3;.
What are the key properties of [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane?
[(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane has a molecular weight of 563.53 g/mol, XLogP of 8.72, 20 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-4-(dimethoxymethyl)-1-tributylstannyloct-1-en-4-yl]oxy-trimethylsilane is sourced from PubChem (CID 12786207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).