3,3,3-trifluoropropyl hypoiodite

C3H4F3IO — CID 88972470

IUPAC3,3,3-trifluoropropyl hypoiodite
SMILESFC(F)(F)CCOI
InChIInChI=1S/C3H4F3IO/c4-3(5,6)1-2-8-7/h1-2H2
InChIKeyCAGDTQADATXURE-UHFFFAOYSA-N
MW239.96 g/mol
LogP2.31
Rot. Bonds2

About 3,3,3-trifluoropropyl hypoiodite

3,3,3-trifluoropropyl hypoiodite (PubChem CID 88972470) has the molecular formula C3H4F3IO and a molecular weight of 239.96 g/mol. Its IUPAC name is 3,3,3-trifluoropropyl hypoiodite.

Molecular Properties

Compound Name3,3,3-trifluoropropyl hypoiodite
PubChem CID88972470
Molecular FormulaC3H4F3IO
Molecular Weight239.96 g/mol
Exact Mass239.93
IUPAC Name3,3,3-trifluoropropyl hypoiodite
SMILESFC(F)(F)CCOI
InChIInChI=1S/C3H4F3IO/c4-3(5,6)1-2-8-7/h1-2H2
InChIKeyCAGDTQADATXURE-UHFFFAOYSA-N
XLogP2.31
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.96
LogP ≤ 52.31
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 3,3,3-trifluoropropyl hypoiodite?
The IUPAC name of 3,3,3-trifluoropropyl hypoiodite (CID 88972470) is 3,3,3-trifluoropropyl hypoiodite.
What is the SMILES notation for 3,3,3-trifluoropropyl hypoiodite?
The canonical SMILES for 3,3,3-trifluoropropyl hypoiodite is FC(F)(F)CCOI.
What is the InChIKey of 3,3,3-trifluoropropyl hypoiodite?
The InChIKey is CAGDTQADATXURE-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4F3IO/c4-3(5,6)1-2-8-7/h1-2H2.
What are the key properties of 3,3,3-trifluoropropyl hypoiodite?
3,3,3-trifluoropropyl hypoiodite has a molecular weight of 239.96 g/mol, XLogP of 2.31, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3,3-trifluoropropyl hypoiodite is sourced from PubChem (CID 88972470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).