tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane

C12H25IOSi — CID 53392287

IUPACtert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane
SMILESC=C(C)C(CCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H25IOSi/c1-10(2)11(8-9-13)14-15(6,7)12(3,4)5/h11H,1,8-9H2,2-7H3
InChIKeyCZOGUHQBRYQKTF-UHFFFAOYSA-N
MW340.32 g/mol
LogP4.78
Rot. Bonds5

About tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane

tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane (PubChem CID 53392287) has the molecular formula C12H25IOSi and a molecular weight of 340.32 g/mol. Its IUPAC name is tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane
PubChem CID53392287
Molecular FormulaC12H25IOSi
Molecular Weight340.32 g/mol
Exact Mass340.07
IUPAC Nametert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane
SMILESC=C(C)C(CCI)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H25IOSi/c1-10(2)11(8-9-13)14-15(6,7)12(3,4)5/h11H,1,8-9H2,2-7H3
InChIKeyCZOGUHQBRYQKTF-UHFFFAOYSA-N
XLogP4.78
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.32
LogP ≤ 54.78
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

tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane
CID 101446444
2-[tert-butyl(dimethyl)silyl]oxy-4-iodobutanoic acid
CID 154140046
tert-butyl-[(2S)-4-iodobutan-2-yl]oxy-dimethylsilane
CID 10946949
tert-butyl-(4-iodobutan-2-yloxy)-dimethylsilane
CID 11130810
tert-butyl-dimethyl-(3-methylbut-3-en-2-yloxy)silane
CID 15935934
tert-butyl-[(3R)-1-iodopentan-3-yl]oxy-dimethylsilane
CID 15939181
tert-butyl-[(1Z,3S)-1-iodo-6-methylhepta-1,6-dien-3-yl]oxy-dimethylsilane
CID 134898148
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxypentan-2-one
CID 10633359
tert-butyl-[(Z)-1-iodo-3-methylnon-2-en-4-yl]oxy-dimethylsilane
CID 134846992
tert-butyl-[(3R)-1-iododecan-3-yl]oxy-dimethylsilane
CID 140734279
3-[tert-butyl(dimethyl)silyl]oxyoctadecan-2-one
CID 46237114
(2R)-2-[tert-butyl(dimethyl)silyl]oxybutanoic acid
CID 87507546

Frequently Asked Questions

What is the IUPAC name of tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane?
The IUPAC name of tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane (CID 53392287) is tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane.
What is the SMILES notation for tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane?
The canonical SMILES for tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane is C=C(C)C(CCI)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane?
The InChIKey is CZOGUHQBRYQKTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25IOSi/c1-10(2)11(8-9-13)14-15(6,7)12(3,4)5/h11H,1,8-9H2,2-7H3.
What are the key properties of tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane?
tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane has a molecular weight of 340.32 g/mol, XLogP of 4.78, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane is sourced from PubChem (CID 53392287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).