2-hydroxy-6-iodobenzaldehyde

C7H5IO2 — CID 12023200

IUPAC2-hydroxy-6-iodobenzaldehyde
SMILESO=Cc1c(O)cccc1I
InChIInChI=1S/C7H5IO2/c8-6-2-1-3-7(10)5(6)4-9/h1-4,10H
InChIKeyOMXBWJYYNNGFIV-UHFFFAOYSA-N
MW248.02 g/mol
LogP1.81
Rot. Bonds1

About 2-hydroxy-6-iodobenzaldehyde

2-hydroxy-6-iodobenzaldehyde (PubChem CID 12023200) has the molecular formula C7H5IO2 and a molecular weight of 248.02 g/mol. Its IUPAC name is 2-hydroxy-6-iodobenzaldehyde.

Molecular Properties

Compound Name2-hydroxy-6-iodobenzaldehyde
PubChem CID12023200
Molecular FormulaC7H5IO2
Molecular Weight248.02 g/mol
Exact Mass247.93
IUPAC Name2-hydroxy-6-iodobenzaldehyde
SMILESO=Cc1c(O)cccc1I
InChIInChI=1S/C7H5IO2/c8-6-2-1-3-7(10)5(6)4-9/h1-4,10H
InChIKeyOMXBWJYYNNGFIV-UHFFFAOYSA-N
XLogP1.81
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.02
LogP ≤ 51.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-6-iodobenzaldehyde?
The IUPAC name of 2-hydroxy-6-iodobenzaldehyde (CID 12023200) is 2-hydroxy-6-iodobenzaldehyde.
What is the SMILES notation for 2-hydroxy-6-iodobenzaldehyde?
The canonical SMILES for 2-hydroxy-6-iodobenzaldehyde is O=Cc1c(O)cccc1I.
What is the InChIKey of 2-hydroxy-6-iodobenzaldehyde?
The InChIKey is OMXBWJYYNNGFIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5IO2/c8-6-2-1-3-7(10)5(6)4-9/h1-4,10H.
What are the key properties of 2-hydroxy-6-iodobenzaldehyde?
2-hydroxy-6-iodobenzaldehyde has a molecular weight of 248.02 g/mol, XLogP of 1.81, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-6-iodobenzaldehyde is sourced from PubChem (CID 12023200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).