2-iodophenol

C6H5IO — CID 10784

IUPAC2-iodophenol
SMILESOc1ccccc1I
InChIInChI=1S/C6H5IO/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChIKeyKQDJTBPASNJQFQ-UHFFFAOYSA-N
MW220.01 g/mol
LogP2.00
Rot. Bonds

About 2-iodophenol

2-iodophenol (PubChem CID 10784) has the molecular formula C6H5IO and a molecular weight of 220.01 g/mol. Its IUPAC name is 2-iodophenol.

Molecular Properties

Compound Name2-iodophenol
PubChem CID10784
Molecular FormulaC6H5IO
Molecular Weight220.01 g/mol
Exact Mass219.94
IUPAC Name2-iodophenol
SMILESOc1ccccc1I
InChIInChI=1S/C6H5IO/c7-5-3-1-2-4-6(5)8/h1-4,8H
InChIKeyKQDJTBPASNJQFQ-UHFFFAOYSA-N
XLogP2.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.01
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-iodophenol;4-iodophenol
CID 67440889
2-iodophenol;3-iodophenol
CID 68975809
2-iodophenol;3,4,5-trichlorophenol
CID 154941480
2,5-dichlorophenol;2-iodophenol
CID 70439012
sodium;2,6-dichlorophenolate;2-iodophenol
CID 175356810
1,2-diiodobenzene;tetrahydrofluoride
CID 174612997
bis(benzene-1,2-diol);methane
CID 158804248
benzene-1,2-diol;ruthenium
CID 175866633
benzene-1,2-diol;vanadium(2+)
CID 159711752
cyclodeca-2,4,6,8,10-pentaene-1,2-diol
CID 143742281
benzene-1,2-diol;zinc
CID 70580296
benzene-1,2-diol;hydrogen peroxide
CID 22924348

Frequently Asked Questions

What is the IUPAC name of 2-iodophenol?
The IUPAC name of 2-iodophenol (CID 10784) is 2-iodophenol.
What is the SMILES notation for 2-iodophenol?
The canonical SMILES for 2-iodophenol is Oc1ccccc1I.
What is the InChIKey of 2-iodophenol?
The InChIKey is KQDJTBPASNJQFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5IO/c7-5-3-1-2-4-6(5)8/h1-4,8H.
What are the key properties of 2-iodophenol?
2-iodophenol has a molecular weight of 220.01 g/mol, XLogP of 2.00, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-iodophenol is sourced from PubChem (CID 10784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).