trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane

C24H52OSiSn — CID 88765999

IUPACtrimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane
SMILESCCCCC(C)C/C=C(\O[Si](C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C12H25OSi.3C4H9.Sn/c1-6-7-9-12(2)10-8-11-13-14(3,4)5;3*1-3-4-2;/h8,12H,6-7,9-10H2,1-5H3;3*1,3-4H2,2H3;
InChIKeyJXPBFQRSSRODEU-UHFFFAOYSA-N
MW503.48 g/mol
LogP9.33
Rot. Bonds17

About trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane

trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane (PubChem CID 88765999) has the molecular formula C24H52OSiSn and a molecular weight of 503.48 g/mol. Its IUPAC name is trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane
PubChem CID88765999
Molecular FormulaC24H52OSiSn
Molecular Weight503.48 g/mol
Exact Mass504.28
IUPAC Nametrimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane
SMILESCCCCC(C)C/C=C(\O[Si](C)(C)C)[Sn](CCCC)(CCCC)CCCC
InChIInChI=1S/C12H25OSi.3C4H9.Sn/c1-6-7-9-12(2)10-8-11-13-14(3,4)5;3*1-3-4-2;/h8,12H,6-7,9-10H2,1-5H3;3*1,3-4H2,2H3;
InChIKeyJXPBFQRSSRODEU-UHFFFAOYSA-N
XLogP9.33
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds17
Heavy Atoms27
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500503.48
LogP ≤ 59.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

3,6-dimethyldeca-1,3-diene
CID 91478498
trimethyl-[(Z)-1-tributylstannyl-3-tri(propan-2-yl)silyloxyprop-1-enyl]silane
CID 10348129
10-methyl-7-pent-1-enyltetradeca-5,7-diene
CID 173291394
trimethylsilyl 8-methyltetradecanoate
CID 526098
trimethylsilyl 10-methyltricosanoate
CID 91747658
trimethyl-[(E)-1-tributylstannyloct-1-enyl]silane
CID 177468758
(E)-5-methyltetradec-7-ene
CID 173194503
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-5-tributylstannylhex-4-en-2-ol
CID 134947532
2,5-dimethylheptadec-2-en-1-amine
CID 91321312
trimethyl-[(1Z,3Z)-7-methyl-1-phenyl-2-tributylstannylocta-1,3-dien-3-yl]silane
CID 177423800
2,6-dimethyldeca-2,3-diene
CID 123175368
[(E)-2-(4-methoxyphenoxy)-2-tributylstannylethenyl]-tris(trimethylsilyl)silane
CID 134847798

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane?
The IUPAC name of trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane (CID 88765999) is trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane.
What is the SMILES notation for trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane?
The canonical SMILES for trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane is CCCCC(C)C/C=C(\O[Si](C)(C)C)[Sn](CCCC)(CCCC)CCCC.
What is the InChIKey of trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane?
The InChIKey is JXPBFQRSSRODEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25OSi.3C4H9.Sn/c1-6-7-9-12(2)10-8-11-13-14(3,4)5;3*1-3-4-2;/h8,12H,6-7,9-10H2,1-5H3;3*1,3-4H2,2H3;.
What are the key properties of trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane?
trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane has a molecular weight of 503.48 g/mol, XLogP of 9.33, 17 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-4-methyl-1-tributylstannyloct-1-enoxy]silane is sourced from PubChem (CID 88765999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).