tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane

C13H28O2Si — CID 15129107

IUPACtert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane
SMILESCO/C(=C\C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2,3)10-11(14-7)15-16(8,9)13(4,5)6/h10H,1-9H3/b11-10+
InChIKeyMVYXMFAKFZXJQL-ZHACJKMWSA-N
MW244.45 g/mol
LogP4.54
Rot. Bonds3

About tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane

tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane (PubChem CID 15129107) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane
PubChem CID15129107
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Nametert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane
SMILESCO/C(=C\C(C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-12(2,3)10-11(14-7)15-16(8,9)13(4,5)6/h10H,1-9H3/b11-10+
InChIKeyMVYXMFAKFZXJQL-ZHACJKMWSA-N
XLogP4.54
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 ≤ 54.54
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-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane (CID 15129107) is tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane is CO/C(=C\C(C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane?
The InChIKey is MVYXMFAKFZXJQL-ZHACJKMWSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-12(2,3)10-11(14-7)15-16(8,9)13(4,5)6/h10H,1-9H3/b11-10+.
What are the key properties of tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane?
tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane has a molecular weight of 244.45 g/mol, XLogP of 4.54, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-1-methoxy-3,3-dimethylbut-1-enoxy]-dimethylsilane is sourced from PubChem (CID 15129107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).