tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane

C11H23IOSi — CID 11186422

IUPACtert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC/C=C/I
InChIInChI=1S/C11H23IOSi/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h7,9H,6,8,10H2,1-5H3/b9-7+
InChIKeyJGUGHYHJBQGWQU-VQHVLOKHSA-N
MW326.29 g/mol
LogP4.74
Rot. Bonds5

About tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane

tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane (PubChem CID 11186422) has the molecular formula C11H23IOSi and a molecular weight of 326.29 g/mol. Its IUPAC name is tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane
PubChem CID11186422
Molecular FormulaC11H23IOSi
Molecular Weight326.29 g/mol
Exact Mass326.06
IUPAC Nametert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)OCCC/C=C/I
InChIInChI=1S/C11H23IOSi/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h7,9H,6,8,10H2,1-5H3/b9-7+
InChIKeyJGUGHYHJBQGWQU-VQHVLOKHSA-N
XLogP4.74
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.29
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane (CID 11186422) is tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane is CC(C)(C)[Si](C)(C)OCCC/C=C/I.
What is the InChIKey of tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane?
The InChIKey is JGUGHYHJBQGWQU-VQHVLOKHSA-N. The full InChI is InChI=1S/C11H23IOSi/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h7,9H,6,8,10H2,1-5H3/b9-7+.
What are the key properties of tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane?
tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane has a molecular weight of 326.29 g/mol, XLogP of 4.74, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(E)-5-iodopent-4-enoxy]-dimethylsilane is sourced from PubChem (CID 11186422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).