[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane

C23H50O4Si3 — CID 58841437

IUPAC[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane
SMILESC=CC(C)CC/C=C(/C)C(CC)CC[Si](C)(C)O[Si](C)(C)CC[Si](OC)(OC)OC
InChIInChI=1S/C23H50O4Si3/c1-12-21(3)15-14-16-22(4)23(13-2)17-18-28(8,9)27-29(10,11)19-20-30(24-5,25-6)26-7/h12,16,21,23H,1,13-15,17-20H2,2-11H3/b22-16-
InChIKeyPWBIKQODGGONDY-JWGURIENSA-N
MW474.91 g/mol
LogP7.26
Rot. Bonds17

About [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane

[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane (PubChem CID 58841437) has the molecular formula C23H50O4Si3 and a molecular weight of 474.91 g/mol. Its IUPAC name is [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane.

Molecular Properties

Compound Name[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane
PubChem CID58841437
Molecular FormulaC23H50O4Si3
Molecular Weight474.91 g/mol
Exact Mass474.30
IUPAC Name[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane
SMILESC=CC(C)CC/C=C(/C)C(CC)CC[Si](C)(C)O[Si](C)(C)CC[Si](OC)(OC)OC
InChIInChI=1S/C23H50O4Si3/c1-12-21(3)15-14-16-22(4)23(13-2)17-18-28(8,9)27-29(10,11)19-20-30(24-5,25-6)26-7/h12,16,21,23H,1,13-15,17-20H2,2-11H3/b22-16-
InChIKeyPWBIKQODGGONDY-JWGURIENSA-N
XLogP7.26
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.91
LogP ≤ 57.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane?
The IUPAC name of [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane (CID 58841437) is [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane.
What is the SMILES notation for [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane?
The canonical SMILES for [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane is C=CC(C)CC/C=C(/C)C(CC)CC[Si](C)(C)O[Si](C)(C)CC[Si](OC)(OC)OC.
What is the InChIKey of [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane?
The InChIKey is PWBIKQODGGONDY-JWGURIENSA-N. The full InChI is InChI=1S/C23H50O4Si3/c1-12-21(3)15-14-16-22(4)23(13-2)17-18-28(8,9)27-29(10,11)19-20-30(24-5,25-6)26-7/h12,16,21,23H,1,13-15,17-20H2,2-11H3/b22-16-.
What are the key properties of [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane?
[dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane has a molecular weight of 474.91 g/mol, XLogP of 7.26, 17 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [dimethyl(2-trimethoxysilylethyl)silyl]oxy-[(4Z)-3-ethyl-4,8-dimethyldeca-4,9-dienyl]-dimethylsilane is sourced from PubChem (CID 58841437), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).