dibutyl-iodo-methylsilane

C9H21ISi — CID 102064396

IUPACdibutyl-iodo-methylsilane
SMILESCCCC[Si](C)(I)CCCC
InChIInChI=1S/C9H21ISi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3
InChIKeyFXZJDXGJYGYLQK-UHFFFAOYSA-N
MW284.26 g/mol
LogP4.60
Rot. Bonds6

About dibutyl-iodo-methylsilane

dibutyl-iodo-methylsilane (PubChem CID 102064396) has the molecular formula C9H21ISi and a molecular weight of 284.26 g/mol. Its IUPAC name is dibutyl-iodo-methylsilane.

Molecular Properties

Compound Namedibutyl-iodo-methylsilane
PubChem CID102064396
Molecular FormulaC9H21ISi
Molecular Weight284.26 g/mol
Exact Mass284.05
IUPAC Namedibutyl-iodo-methylsilane
SMILESCCCC[Si](C)(I)CCCC
InChIInChI=1S/C9H21ISi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3
InChIKeyFXZJDXGJYGYLQK-UHFFFAOYSA-N
XLogP4.60
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.26
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dibutyl-iodo-methylsilane?
The IUPAC name of dibutyl-iodo-methylsilane (CID 102064396) is dibutyl-iodo-methylsilane.
What is the SMILES notation for dibutyl-iodo-methylsilane?
The canonical SMILES for dibutyl-iodo-methylsilane is CCCC[Si](C)(I)CCCC.
What is the InChIKey of dibutyl-iodo-methylsilane?
The InChIKey is FXZJDXGJYGYLQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H21ISi/c1-4-6-8-11(3,10)9-7-5-2/h4-9H2,1-3H3.
What are the key properties of dibutyl-iodo-methylsilane?
dibutyl-iodo-methylsilane has a molecular weight of 284.26 g/mol, XLogP of 4.60, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dibutyl-iodo-methylsilane is sourced from PubChem (CID 102064396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).