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

C13H28O2Si — CID 11075696

IUPACtert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
SMILESC/C=C(\OC(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-10-11(14-12(2,3)4)15-16(8,9)13(5,6)7/h10H,1-9H3/b11-10+
InChIKeyJUUJDDZIPSHAEC-ZHACJKMWSA-N
MW244.45 g/mol
LogP4.68
Rot. Bonds3

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

tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane (PubChem CID 11075696) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
PubChem CID11075696
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nametert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane
SMILESC/C=C(\OC(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-10-11(14-12(2,3)4)15-16(8,9)13(5,6)7/h10H,1-9H3/b11-10+
InChIKeyJUUJDDZIPSHAEC-ZHACJKMWSA-N
XLogP4.68
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 54.68
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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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane (CID 11075696) is tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane is C/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]prop-1-enoxy]silane?
The InChIKey is JUUJDDZIPSHAEC-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-10-11(14-12(2,3)4)15-16(8,9)13(5,6)7/h10H,1-9H3/b11-10+.
What are the key properties of tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane?
tert-butyl-dimethyl-[(E)-1-[(2-methylpropan-2-yl)oxy]prop-1-enoxy]silane has a molecular weight of 244.45 g/mol, XLogP of 4.68, 3 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]prop-1-enoxy]silane is sourced from PubChem (CID 11075696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).