triethyl-λ3-iodane

C6H15I — CID 147422602

IUPACtriethyl-λ3-iodane
SMILESCCI(CC)CC
InChIInChI=1S/C6H15I/c1-4-7(5-2)6-3/h4-6H2,1-3H3
InChIKeyYRJOQGBNFGNRAW-UHFFFAOYSA-N
MW214.09 g/mol
LogP2.55
Rot. Bonds3

About triethyl-λ3-iodane

triethyl-λ3-iodane (PubChem CID 147422602) has the molecular formula C6H15I and a molecular weight of 214.09 g/mol. Its IUPAC name is triethyl-λ3-iodane.

Molecular Properties

Compound Nametriethyl-λ3-iodane
PubChem CID147422602
Molecular FormulaC6H15I
Molecular Weight214.09 g/mol
Exact Mass214.02
IUPAC Nametriethyl-λ3-iodane
SMILESCCI(CC)CC
InChIInChI=1S/C6H15I/c1-4-7(5-2)6-3/h4-6H2,1-3H3
InChIKeyYRJOQGBNFGNRAW-UHFFFAOYSA-N
XLogP2.55
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.09
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethyl(dimethyl)-λ3-iodane
CID 87059731
propane trihydroxide
CID 18172989
propane;ruthenium
CID 161061794
CID 159053021
CID 159053021
methane;propane
CID 162082112
copper;propane
CID 159395647
europium;propane
CID 174351611
methane;propane
CID 160994941
sodium propane
CID 18410128
cyclohexane;diethyl(hydroxy)-λ3-iodane;ethane
CID 144538497
triethyl(methyl)alumanuide
CID 19693700
diethyl(fluoro)silane
CID 71374564

Frequently Asked Questions

What is the IUPAC name of triethyl-λ3-iodane?
The IUPAC name of triethyl-λ3-iodane (CID 147422602) is triethyl-λ3-iodane.
What is the SMILES notation for triethyl-λ3-iodane?
The canonical SMILES for triethyl-λ3-iodane is CCI(CC)CC.
What is the InChIKey of triethyl-λ3-iodane?
The InChIKey is YRJOQGBNFGNRAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H15I/c1-4-7(5-2)6-3/h4-6H2,1-3H3.
What are the key properties of triethyl-λ3-iodane?
triethyl-λ3-iodane has a molecular weight of 214.09 g/mol, XLogP of 2.55, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for triethyl-λ3-iodane is sourced from PubChem (CID 147422602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).