methane;trifluoromethyl hypoiodite

C2H4F3IO — CID 146595452

IUPACmethane;trifluoromethyl hypoiodite
SMILESC.FC(F)(F)OI
InChIInChI=1S/CF3IO.CH4/c2-1(3,4)6-5;/h;1H4
InChIKeyPZYWXFOHCALVJR-UHFFFAOYSA-N
MW227.95 g/mol
LogP2.51
Rot. Bonds

About methane;trifluoromethyl hypoiodite

methane;trifluoromethyl hypoiodite (PubChem CID 146595452) has the molecular formula C2H4F3IO and a molecular weight of 227.95 g/mol. Its IUPAC name is methane;trifluoromethyl hypoiodite.

Molecular Properties

Compound Namemethane;trifluoromethyl hypoiodite
PubChem CID146595452
Molecular FormulaC2H4F3IO
Molecular Weight227.95 g/mol
Exact Mass227.93
IUPAC Namemethane;trifluoromethyl hypoiodite
SMILESC.FC(F)(F)OI
InChIInChI=1S/CF3IO.CH4/c2-1(3,4)6-5;/h;1H4
InChIKeyPZYWXFOHCALVJR-UHFFFAOYSA-N
XLogP2.51
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.95
LogP ≤ 52.51
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 methane;trifluoromethyl hypoiodite?
The IUPAC name of methane;trifluoromethyl hypoiodite (CID 146595452) is methane;trifluoromethyl hypoiodite.
What is the SMILES notation for methane;trifluoromethyl hypoiodite?
The canonical SMILES for methane;trifluoromethyl hypoiodite is C.FC(F)(F)OI.
What is the InChIKey of methane;trifluoromethyl hypoiodite?
The InChIKey is PZYWXFOHCALVJR-UHFFFAOYSA-N. The full InChI is InChI=1S/CF3IO.CH4/c2-1(3,4)6-5;/h;1H4.
What are the key properties of methane;trifluoromethyl hypoiodite?
methane;trifluoromethyl hypoiodite has a molecular weight of 227.95 g/mol, XLogP of 2.51, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methane;trifluoromethyl hypoiodite is sourced from PubChem (CID 146595452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).