difluoro(iodo)methanesulfonyl iodide

CF2I2O2S — CID 143365463

IUPACdifluoro(iodo)methanesulfonyl iodide
SMILESO=S(=O)(I)C(F)(F)I
InChIInChI=1S/CF2I2O2S/c2-1(3,4)8(5,6)7
InChIKeyHOTLXXRITIWZCL-UHFFFAOYSA-N
MW367.88 g/mol
LogP1.74
Rot. Bonds1

About difluoro(iodo)methanesulfonyl iodide

difluoro(iodo)methanesulfonyl iodide (PubChem CID 143365463) has the molecular formula CF2I2O2S and a molecular weight of 367.88 g/mol. Its IUPAC name is difluoro(iodo)methanesulfonyl iodide.

Molecular Properties

Compound Namedifluoro(iodo)methanesulfonyl iodide
PubChem CID143365463
Molecular FormulaCF2I2O2S
Molecular Weight367.88 g/mol
Exact Mass367.77
IUPAC Namedifluoro(iodo)methanesulfonyl iodide
SMILESO=S(=O)(I)C(F)(F)I
InChIInChI=1S/CF2I2O2S/c2-1(3,4)8(5,6)7
InChIKeyHOTLXXRITIWZCL-UHFFFAOYSA-N
XLogP1.74
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.88
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

fluoro difluoro(iodo)methanesulfonate
CID 175456867
1,1,2,2,3,3,3-heptafluoropropane-1-sulfonyl iodide
CID 87237688
1,1,2,3,3,3-hexafluoro-2-(trifluoromethyl)propane-1-sulfonyl iodide
CID 89346717
trifluoro-[iodo-bis(trifluoromethylsulfonyl)methyl]sulfonylmethane
CID 141352262
2,2,2-trifluoroethanesulfonyl iodide
CID 147408811
1,1,2,2-tetrafluoro-2-iodoethanesulfonyl fluoride
CID 19898065
sulfuryl diiodide
CID 22177328
iodomethane;trifluoromethanesulfonic acid
CID 87959782
trifluoro(iodo)methane;zinc
CID 88708055
platinum;trifluoromethanesulfonic acid
CID 87655055
trifluoromethylsulfonylazanide
CID 18339154
trifluoromethanesulfonic acid;hydrofluoride
CID 87139590

Frequently Asked Questions

What is the IUPAC name of difluoro(iodo)methanesulfonyl iodide?
The IUPAC name of difluoro(iodo)methanesulfonyl iodide (CID 143365463) is difluoro(iodo)methanesulfonyl iodide.
What is the SMILES notation for difluoro(iodo)methanesulfonyl iodide?
The canonical SMILES for difluoro(iodo)methanesulfonyl iodide is O=S(=O)(I)C(F)(F)I.
What is the InChIKey of difluoro(iodo)methanesulfonyl iodide?
The InChIKey is HOTLXXRITIWZCL-UHFFFAOYSA-N. The full InChI is InChI=1S/CF2I2O2S/c2-1(3,4)8(5,6)7.
What are the key properties of difluoro(iodo)methanesulfonyl iodide?
difluoro(iodo)methanesulfonyl iodide has a molecular weight of 367.88 g/mol, XLogP of 1.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for difluoro(iodo)methanesulfonyl iodide is sourced from PubChem (CID 143365463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).