tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane

C10H21IOSi — CID 11358863

IUPACtert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane
SMILESC=C(CI)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H21IOSi/c1-9(7-11)8-12-13(5,6)10(2,3)4/h1,7-8H2,2-6H3
InChIKeyVKWLYYUEAXULEL-UHFFFAOYSA-N
MW312.27 g/mol
LogP4.00
Rot. Bonds4

About tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane

tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane (PubChem CID 11358863) has the molecular formula C10H21IOSi and a molecular weight of 312.27 g/mol. Its IUPAC name is tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane
PubChem CID11358863
Molecular FormulaC10H21IOSi
Molecular Weight312.27 g/mol
Exact Mass312.04
IUPAC Nametert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane
SMILESC=C(CI)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C10H21IOSi/c1-9(7-11)8-12-13(5,6)10(2,3)4/h1,7-8H2,2-6H3
InChIKeyVKWLYYUEAXULEL-UHFFFAOYSA-N
XLogP4.00
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.27
LogP ≤ 54.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-[[tert-butyl(dimethyl)silyl]oxymethyl]but-3-en-1-ol
CID 135040003
tert-butyl-dimethyl-(2-methylidenebut-3-enoxy)silane
CID 10058581
tert-butyl-dimethyl-[2-methylidene-4-(4-octylphenyl)butoxy]silane
CID 71600877
(4S)-2-[[tert-butyl(dimethyl)silyl]oxymethyl]hepta-1,6-dien-4-ol
CID 135040202
tert-butyl-dimethyl-[(E)-2-methylidenehex-3-enoxy]silane
CID 11229887
(2E)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]penta-2,4-dienal
CID 146163181
(4S)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-methylhex-5-en-2-yne-1,4-diol
CID 102483527
4-[tert-butyl(dimethyl)silyl]oxy-3-methylbut-2-en-1-ol
CID 71340946
(2S)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-1-(4-tert-butylphenyl)but-3-en-2-ol
CID 12027942
3-[tert-butyl(dimethyl)silyl]oxy-2,2-dimethylpropane-1,1-diol
CID 123722416
tert-butyl-(2,2-difluoropropoxy)-dimethylsilane
CID 123170783
(2E)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]penta-2,4-dienal
CID 101238269

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane (CID 11358863) is tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane is C=C(CI)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane?
The InChIKey is VKWLYYUEAXULEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21IOSi/c1-9(7-11)8-12-13(5,6)10(2,3)4/h1,7-8H2,2-6H3.
What are the key properties of tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane?
tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane has a molecular weight of 312.27 g/mol, XLogP of 4.00, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-(iodomethyl)prop-2-enoxy]-dimethylsilane is sourced from PubChem (CID 11358863), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).