(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane

C22H46O3Si2 — CID 138974679

IUPAC(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane
SMILESCCCCCCCCCCC=C(C=C(OCC)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C22H46O3Si2/c1-9-11-12-13-14-15-16-17-18-19-21(24-26(3,4)5)20-22(23-10-2)25-27(6,7)8/h19-20H,9-18H2,1-8H3
InChIKeyFDZWEJPRFJJPSK-UHFFFAOYSA-N
MW414.78 g/mol
LogP7.98
Rot. Bonds16

About (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane

(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane (PubChem CID 138974679) has the molecular formula C22H46O3Si2 and a molecular weight of 414.78 g/mol. Its IUPAC name is (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane.

Molecular Properties

Compound Name(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane
PubChem CID138974679
Molecular FormulaC22H46O3Si2
Molecular Weight414.78 g/mol
Exact Mass414.30
IUPAC Name(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane
SMILESCCCCCCCCCCC=C(C=C(OCC)O[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C22H46O3Si2/c1-9-11-12-13-14-15-16-17-18-19-21(24-26(3,4)5)20-22(23-10-2)25-27(6,7)8/h19-20H,9-18H2,1-8H3
InChIKeyFDZWEJPRFJJPSK-UHFFFAOYSA-N
XLogP7.98
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds16
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500414.78
LogP ≤ 57.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane?
The IUPAC name of (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane (CID 138974679) is (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane.
What is the SMILES notation for (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane?
The canonical SMILES for (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane is CCCCCCCCCCC=C(C=C(OCC)O[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane?
The InChIKey is FDZWEJPRFJJPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H46O3Si2/c1-9-11-12-13-14-15-16-17-18-19-21(24-26(3,4)5)20-22(23-10-2)25-27(6,7)8/h19-20H,9-18H2,1-8H3.
What are the key properties of (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane?
(1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane has a molecular weight of 414.78 g/mol, XLogP of 7.98, 16 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethoxy-3-trimethylsilyloxytetradeca-1,3-dienoxy)-trimethylsilane is sourced from PubChem (CID 138974679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).