1,2-diiodobenzene;tetrahydrofluoride

C6H8F4I2 — CID 174612997

IUPAC1,2-diiodobenzene;tetrahydrofluoride
SMILESF.F.F.F.Ic1ccccc1I
InChIInChI=1S/C6H4I2.4FH/c7-5-3-1-2-4-6(5)8;;;;/h1-4H;4*1H
InChIKeyLTKGVTDFKVYLOB-UHFFFAOYSA-N
MW409.93 g/mol
LogP3.51
Rot. Bonds

About 1,2-diiodobenzene;tetrahydrofluoride

1,2-diiodobenzene;tetrahydrofluoride (PubChem CID 174612997) has the molecular formula C6H8F4I2 and a molecular weight of 409.93 g/mol. Its IUPAC name is 1,2-diiodobenzene;tetrahydrofluoride.

Molecular Properties

Compound Name1,2-diiodobenzene;tetrahydrofluoride
PubChem CID174612997
Molecular FormulaC6H8F4I2
Molecular Weight409.93 g/mol
Exact Mass409.87
IUPAC Name1,2-diiodobenzene;tetrahydrofluoride
SMILESF.F.F.F.Ic1ccccc1I
InChIInChI=1S/C6H4I2.4FH/c7-5-3-1-2-4-6(5)8;;;;/h1-4H;4*1H
InChIKeyLTKGVTDFKVYLOB-UHFFFAOYSA-N
XLogP3.51
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.93
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-iodophenol
CID 10784
1-hydroperoxy-2-iodobenzene
CID 164852676
(2-iodophenyl)azanium
CID 23277841
CID 174688719
CID 174688719
1,2,3-triiodobenzene
CID 139071365
2-(2,6-diiodophenyl)-1,3-diiodobenzene
CID 91384938
1-iodo-2-[(E)-2-(2-iodophenyl)ethenyl]benzene
CID 10812610
1-iodo-2-[(2-iodophenyl)methyl]benzene
CID 597023
azane;1-bromo-2-iodobenzene
CID 139491171
1-iodo-2-[2-(2-iodophenyl)ethynyl]benzene
CID 11316350
1-bromo-2-iodobenzene;molecular nitrogen
CID 155706234
CID 101066034
CID 101066034

Frequently Asked Questions

What is the IUPAC name of 1,2-diiodobenzene;tetrahydrofluoride?
The IUPAC name of 1,2-diiodobenzene;tetrahydrofluoride (CID 174612997) is 1,2-diiodobenzene;tetrahydrofluoride.
What is the SMILES notation for 1,2-diiodobenzene;tetrahydrofluoride?
The canonical SMILES for 1,2-diiodobenzene;tetrahydrofluoride is F.F.F.F.Ic1ccccc1I.
What is the InChIKey of 1,2-diiodobenzene;tetrahydrofluoride?
The InChIKey is LTKGVTDFKVYLOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4I2.4FH/c7-5-3-1-2-4-6(5)8;;;;/h1-4H;4*1H.
What are the key properties of 1,2-diiodobenzene;tetrahydrofluoride?
1,2-diiodobenzene;tetrahydrofluoride has a molecular weight of 409.93 g/mol, XLogP of 3.51, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diiodobenzene;tetrahydrofluoride is sourced from PubChem (CID 174612997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).