diphenyliodanium;hydroiodide

C12H11I2+ — CID 54604341

IUPACdiphenyliodanium;hydroiodide
SMILESI.c1ccc([I+]c2ccccc2)cc1
InChIInChI=1S/C12H10I.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10H;1H/q+1;
InChIKeyWQIRVUAXANLUPO-UHFFFAOYSA-N
MW409.03 g/mol
LogP0.43
Rot. Bonds2

About diphenyliodanium;hydroiodide

diphenyliodanium;hydroiodide (PubChem CID 54604341) has the molecular formula C12H11I2+ and a molecular weight of 409.03 g/mol. Its IUPAC name is diphenyliodanium;hydroiodide.

Molecular Properties

Compound Namediphenyliodanium;hydroiodide
PubChem CID54604341
Molecular FormulaC12H11I2+
Molecular Weight409.03 g/mol
Exact Mass408.89
IUPAC Namediphenyliodanium;hydroiodide
SMILESI.c1ccc([I+]c2ccccc2)cc1
InChIInChI=1S/C12H10I.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10H;1H/q+1;
InChIKeyWQIRVUAXANLUPO-UHFFFAOYSA-N
XLogP0.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.03
LogP ≤ 50.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of diphenyliodanium;hydroiodide?
The IUPAC name of diphenyliodanium;hydroiodide (CID 54604341) is diphenyliodanium;hydroiodide.
What is the SMILES notation for diphenyliodanium;hydroiodide?
The canonical SMILES for diphenyliodanium;hydroiodide is I.c1ccc([I+]c2ccccc2)cc1.
What is the InChIKey of diphenyliodanium;hydroiodide?
The InChIKey is WQIRVUAXANLUPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10I.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10H;1H/q+1;.
What are the key properties of diphenyliodanium;hydroiodide?
diphenyliodanium;hydroiodide has a molecular weight of 409.03 g/mol, XLogP of 0.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for diphenyliodanium;hydroiodide is sourced from PubChem (CID 54604341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).