tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane

C11H23IOSi — CID 101405389

IUPACtert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane
SMILESCC(/C=C/I)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H23IOSi/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7-8,10H,9H2,1-6H3/b8-7+
InChIKeyVKZXLSRFOOQEOR-BQYQJAHWSA-N
MW326.29 g/mol
LogP4.59
Rot. Bonds4

About tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane

tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane (PubChem CID 101405389) has the molecular formula C11H23IOSi and a molecular weight of 326.29 g/mol. Its IUPAC name is tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane
PubChem CID101405389
Molecular FormulaC11H23IOSi
Molecular Weight326.29 g/mol
Exact Mass326.06
IUPAC Nametert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane
SMILESCC(/C=C/I)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C11H23IOSi/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7-8,10H,9H2,1-6H3/b8-7+
InChIKeyVKZXLSRFOOQEOR-BQYQJAHWSA-N
XLogP4.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.29
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-dimethyl-[(E)-2-methylpent-3-enoxy]silane
CID 121002381
ethyl (E,4R)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-2-enoate
CID 24755951
(E,2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methyl-N-trimethylsilylpropan-1-imine
CID 11108529
1-[tert-butyl(dimethyl)silyl]oxypropan-2-ol
CID 13175134
tert-butyl-[(2S)-2-fluoropropoxy]-dimethylsilane
CID 141238974
tert-butyl (1S,2S,3R)-2-[(E,3R)-4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-1-enyl]-3-methylcyclopropane-1-carboxylate
CID 46915894
tert-butyl-dimethyl-[(2S)-2-methylbutoxy]silane
CID 133082116
tert-butyl-[(E,2S,5S)-5-cyclohepta-2,4,6-trien-1-yl-2,5-dimethylhept-3-enoxy]-dimethylsilane
CID 154712103
tert-butyl-(4-iodo-2-naphthalen-1-ylbut-3-enoxy)-dimethylsilane
CID 173226598
tert-butyl-[2-(iodomethyl)-3-methylbutoxy]-dimethylsilane
CID 177309340
(2R)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoic acid
CID 87766399
(2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanal;methyl (E,4R)-5-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-2-enoate;methyl (2S)-3-[tert-butyl(dimethyl)silyl]oxy-2-methylpropanoate
CID 159525447

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane (CID 101405389) is tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane is CC(/C=C/I)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane?
The InChIKey is VKZXLSRFOOQEOR-BQYQJAHWSA-N. The full InChI is InChI=1S/C11H23IOSi/c1-10(7-8-12)9-13-14(5,6)11(2,3)4/h7-8,10H,9H2,1-6H3/b8-7+.
What are the key properties of tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane?
tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane has a molecular weight of 326.29 g/mol, XLogP of 4.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-4-iodo-2-methylbut-3-enoxy]-dimethylsilane is sourced from PubChem (CID 101405389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).