2,2-dimethylpropyl hypoiodite

C5H11IO — CID 89321804

IUPAC2,2-dimethylpropyl hypoiodite
SMILESCC(C)(C)COI
InChIInChI=1S/C5H11IO/c1-5(2,3)4-7-6/h4H2,1-3H3
InChIKeyISMRQJWTSMIMHY-UHFFFAOYSA-N
MW214.05 g/mol
LogP2.40
Rot. Bonds1

About 2,2-dimethylpropyl hypoiodite

2,2-dimethylpropyl hypoiodite (PubChem CID 89321804) has the molecular formula C5H11IO and a molecular weight of 214.05 g/mol. Its IUPAC name is 2,2-dimethylpropyl hypoiodite.

Molecular Properties

Compound Name2,2-dimethylpropyl hypoiodite
PubChem CID89321804
Molecular FormulaC5H11IO
Molecular Weight214.05 g/mol
Exact Mass213.99
IUPAC Name2,2-dimethylpropyl hypoiodite
SMILESCC(C)(C)COI
InChIInChI=1S/C5H11IO/c1-5(2,3)4-7-6/h4H2,1-3H3
InChIKeyISMRQJWTSMIMHY-UHFFFAOYSA-N
XLogP2.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.05
LogP ≤ 52.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylpropyl hypoiodite?
The IUPAC name of 2,2-dimethylpropyl hypoiodite (CID 89321804) is 2,2-dimethylpropyl hypoiodite.
What is the SMILES notation for 2,2-dimethylpropyl hypoiodite?
The canonical SMILES for 2,2-dimethylpropyl hypoiodite is CC(C)(C)COI.
What is the InChIKey of 2,2-dimethylpropyl hypoiodite?
The InChIKey is ISMRQJWTSMIMHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11IO/c1-5(2,3)4-7-6/h4H2,1-3H3.
What are the key properties of 2,2-dimethylpropyl hypoiodite?
2,2-dimethylpropyl hypoiodite has a molecular weight of 214.05 g/mol, XLogP of 2.40, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylpropyl hypoiodite is sourced from PubChem (CID 89321804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).