tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane

C19H38OSi2 — CID 146163108

IUPACtert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane
SMILESCCCCCC(/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H38OSi2/c1-10-11-12-15-18(16-13-14-17-21(5,6)7)20-22(8,9)19(2,3)4/h13,16,18H,10-12,15H2,1-9H3/b16-13-
InChIKeyXLULTSSNTYKJJR-SSZFMOIBSA-N
MW338.68 g/mol
LogP6.39
Rot. Bonds7

About tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane

tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane (PubChem CID 146163108) has the molecular formula C19H38OSi2 and a molecular weight of 338.68 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane
PubChem CID146163108
Molecular FormulaC19H38OSi2
Molecular Weight338.68 g/mol
Exact Mass338.25
IUPAC Nametert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane
SMILESCCCCCC(/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C19H38OSi2/c1-10-11-12-15-18(16-13-14-17-21(5,6)7)20-22(8,9)19(2,3)4/h13,16,18H,10-12,15H2,1-9H3/b16-13-
InChIKeyXLULTSSNTYKJJR-SSZFMOIBSA-N
XLogP6.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500338.68
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-[(E)-henicos-8-en-6-yn-11-yl]oxy-dimethylsilane
CID 11247187
[(1S)-cyclohex-2-en-1-yl]oxy-dimethyl-(8-trimethylsilylocta-1,7-diynyl)silane
CID 11393435
tert-butyl-dimethyl-[(Z,2R)-undec-3-en-2-yl]oxysilane
CID 134855917
tert-butyl-dimethyl-[(Z)-octadec-9-en-6-yl]oxysilane
CID 134866255
[(2E,11E)-7,16-dimethylidene-10-triethylsilyloxycyclooctadeca-2,11-dien-1-yl]oxy-triethylsilane
CID 134930766
tert-butyl-[(5R,6E)-5-[tert-butyl(dimethyl)silyl]oxy-7-methyldeca-6,9-dienoxy]-dimethylsilane
CID 134960246
tert-butyl-dimethyl-[(1S)-1-[(Z,1S)-2-trimethylsilyl-1-tri(propan-2-yl)silyloxybut-2-enyl]hexoxy]silane
CID 135059486
[(2E,12E)-3,12-dimethyl-11-triethylsilyloxytetradeca-2,7,12-trien-4-yl]oxy-triethylsilane
CID 135066594
[(2E)-1-(cyclohexen-1-yl)-3-triethylsilylhexa-2,5-dienoxy]-triethylsilane
CID 135068814
tert-butyl-dimethyl-[(Z)-8-trimethylsilyloct-5-en-7-ynoxy]silane
CID 135078784
tert-butyl-dimethyl-[(E,6R)-undec-4-en-1-yn-6-yl]oxysilane
CID 138967347
tert-butyl-dimethyl-[(E,6R)-1-trimethylsilylundec-4-en-1-yn-6-yl]oxysilane
CID 138967662

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane (CID 146163108) is tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane is CCCCCC(/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane?
The InChIKey is XLULTSSNTYKJJR-SSZFMOIBSA-N. The full InChI is InChI=1S/C19H38OSi2/c1-10-11-12-15-18(16-13-14-17-21(5,6)7)20-22(8,9)19(2,3)4/h13,16,18H,10-12,15H2,1-9H3/b16-13-.
What are the key properties of tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane?
tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane has a molecular weight of 338.68 g/mol, XLogP of 6.39, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane is sourced from PubChem (CID 146163108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).