tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane

C14H30O2Si — CID 10923224

IUPACtert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane
SMILESCC/C=C(\OC(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O2Si/c1-10-11-12(15-13(2,3)4)16-17(8,9)14(5,6)7/h11H,10H2,1-9H3/b12-11+
InChIKeyWDNIVLKZOYZCMO-VAWYXSNFSA-N
MW258.48 g/mol
LogP5.07
Rot. Bonds4

About tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane

tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane (PubChem CID 10923224) has the molecular formula C14H30O2Si and a molecular weight of 258.48 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane
PubChem CID10923224
Molecular FormulaC14H30O2Si
Molecular Weight258.48 g/mol
Exact Mass258.20
IUPAC Nametert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane
SMILESCC/C=C(\OC(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C14H30O2Si/c1-10-11-12(15-13(2,3)4)16-17(8,9)14(5,6)7/h11H,10H2,1-9H3/b12-11+
InChIKeyWDNIVLKZOYZCMO-VAWYXSNFSA-N
XLogP5.07
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500258.48
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

(1E)-1-tert-Butoxy-1-(trimethylsilyloxy)propene
CID 11019956
(1E)-1-tert-Butoxy-1-(tert-butyldimethylsiloxy)propene
CID 11075696
tert-butyl-dimethyl-[(Z)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
CID 13459716
tert-butyl-dimethyl-[(1Z)-1-[(2-methylpropan-2-yl)oxy]buta-1,3-dienoxy]silane
CID 146018189
(1Z)-1-tert-Butoxy-1-(trimethylsiloxy)propene
CID 10878232
(1-tert-Butoxy-vinyloxy)-tert-butyl-dimethyl-silane
CID 10922347
trimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane
CID 11746052
[(1-tert-Butoxyprop-1-en-1-yl)oxy](trimethyl)silane
CID 57353179
tert-butyl-[(E)-1-ethoxybut-1-enoxy]-dimethylsilane
CID 12000452
tert-butyl-[(E)-1-methoxybut-1-enoxy]-dimethylsilane
CID 13736758
tert-butyl-[(Z)-1-methoxybut-1-enoxy]-dimethylsilane
CID 13736759
tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane
CID 15129107

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane (CID 10923224) is tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane is CC/C=C(\OC(C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane?
The InChIKey is WDNIVLKZOYZCMO-VAWYXSNFSA-N. The full InChI is InChI=1S/C14H30O2Si/c1-10-11-12(15-13(2,3)4)16-17(8,9)14(5,6)7/h11H,10H2,1-9H3/b12-11+.
What are the key properties of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane?
tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane has a molecular weight of 258.48 g/mol, XLogP of 5.07, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]but-1-enoxy]silane is sourced from PubChem (CID 10923224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).