4-iodobut-2-en-2-yl(trimethyl)silane

C7H15ISi — CID 53428145

IUPAC4-iodobut-2-en-2-yl(trimethyl)silane
SMILESCC(=CCI)[Si](C)(C)C
InChIInChI=1S/C7H15ISi/c1-7(5-6-8)9(2,3)4/h5H,6H2,1-4H3
InChIKeyNWNYZMZBMPWCQQ-UHFFFAOYSA-N
MW254.19 g/mol
LogP3.25
Rot. Bonds2

About 4-iodobut-2-en-2-yl(trimethyl)silane

4-iodobut-2-en-2-yl(trimethyl)silane (PubChem CID 53428145) has the molecular formula C7H15ISi and a molecular weight of 254.19 g/mol. Its IUPAC name is 4-iodobut-2-en-2-yl(trimethyl)silane.

Molecular Properties

Compound Name4-iodobut-2-en-2-yl(trimethyl)silane
PubChem CID53428145
Molecular FormulaC7H15ISi
Molecular Weight254.19 g/mol
Exact Mass254.00
IUPAC Name4-iodobut-2-en-2-yl(trimethyl)silane
SMILESCC(=CCI)[Si](C)(C)C
InChIInChI=1S/C7H15ISi/c1-7(5-6-8)9(2,3)4/h5H,6H2,1-4H3
InChIKeyNWNYZMZBMPWCQQ-UHFFFAOYSA-N
XLogP3.25
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.19
LogP ≤ 53.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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'}

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Frequently Asked Questions

What is the IUPAC name of 4-iodobut-2-en-2-yl(trimethyl)silane?
The IUPAC name of 4-iodobut-2-en-2-yl(trimethyl)silane (CID 53428145) is 4-iodobut-2-en-2-yl(trimethyl)silane.
What is the SMILES notation for 4-iodobut-2-en-2-yl(trimethyl)silane?
The canonical SMILES for 4-iodobut-2-en-2-yl(trimethyl)silane is CC(=CCI)[Si](C)(C)C.
What is the InChIKey of 4-iodobut-2-en-2-yl(trimethyl)silane?
The InChIKey is NWNYZMZBMPWCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15ISi/c1-7(5-6-8)9(2,3)4/h5H,6H2,1-4H3.
What are the key properties of 4-iodobut-2-en-2-yl(trimethyl)silane?
4-iodobut-2-en-2-yl(trimethyl)silane has a molecular weight of 254.19 g/mol, XLogP of 3.25, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodobut-2-en-2-yl(trimethyl)silane is sourced from PubChem (CID 53428145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).