(2-chlorophenyl)iodanium

C6H5ClI+ — CID 18427197

IUPAC(2-chlorophenyl)iodanium
SMILESClc1ccccc1[IH+]
InChIInChI=1S/C6H5ClI/c7-5-3-1-2-4-6(5)8/h1-4,8H/q+1
InChIKeySKHORTQQMOJOSW-UHFFFAOYSA-N
MW239.46 g/mol
LogP-1.20
Rot. Bonds

About (2-chlorophenyl)iodanium

(2-chlorophenyl)iodanium (PubChem CID 18427197) has the molecular formula C6H5ClI+ and a molecular weight of 239.46 g/mol. Its IUPAC name is (2-chlorophenyl)iodanium.

Molecular Properties

Compound Name(2-chlorophenyl)iodanium
PubChem CID18427197
Molecular FormulaC6H5ClI+
Molecular Weight239.46 g/mol
Exact Mass238.91
IUPAC Name(2-chlorophenyl)iodanium
SMILESClc1ccccc1[IH+]
InChIInChI=1S/C6H5ClI/c7-5-3-1-2-4-6(5)8/h1-4,8H/q+1
InChIKeySKHORTQQMOJOSW-UHFFFAOYSA-N
XLogP-1.20
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.46
LogP ≤ 5-1.20
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 (2-chlorophenyl)iodanium?
The IUPAC name of (2-chlorophenyl)iodanium (CID 18427197) is (2-chlorophenyl)iodanium.
What is the SMILES notation for (2-chlorophenyl)iodanium?
The canonical SMILES for (2-chlorophenyl)iodanium is Clc1ccccc1[IH+].
What is the InChIKey of (2-chlorophenyl)iodanium?
The InChIKey is SKHORTQQMOJOSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5ClI/c7-5-3-1-2-4-6(5)8/h1-4,8H/q+1.
What are the key properties of (2-chlorophenyl)iodanium?
(2-chlorophenyl)iodanium has a molecular weight of 239.46 g/mol, XLogP of -1.20, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)iodanium is sourced from PubChem (CID 18427197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).