4-Hydroxy-3-iodobenzaldehyde

C₇H₅IO₂CAS 60032-63-5248.02 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₅IO₂
Molar mass: 248.02 g/mol
Exact mass: 247.9334 Da
logP: 1.81Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

60032-63-5

SMILES

C1=CC(=C(C=C1C=O)I)O

InChIKey

KNQVIRRXVOTGGT-UHFFFAOYSA-N

InChI

InChI=1S/C7H5IO2/c8-6-3-5(4-9)1-2-7(6)10/h1-4,10H

Weigh it out

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Names and synonyms

1 names

3-Iodo-4-hydroxybenzaldehyde

Work with 4-Hydroxy-3-iodobenzaldehyde

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Protocatechuic aldehyde139-85-564 % similar 4-Hydroxy-3-methylbenzaldehyde15174-69-361 % similar 4-Hydroxyisophthalaldehyde3328-70-960 % similar 4-Hydroxy-3,5-diiodobenzaldehyde1948-40-957 % similar 3-Chloro-4-hydroxybenzaldehyde2420-16-856 % similar 3-Bromo-4-hydroxybenzaldehyde2973-78-656 % similar 3-Fluoro-4-hydroxybenzaldehyde405-05-056 % similar 3-Hydroxy-4-methylbenzaldehyde57295-30-456 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Hydroxy-4-iodobenzaldehyde135242-71-6 5-Iodosalicylaldehyde1761-62-2 1-Iodo-3,4-methylenedioxybenzene5876-51-7 3-Iodobenzoic acid618-51-9 4-Iodobenzoic acid619-58-9 2-Iodobenzoic acid88-67-5

Elsewhere

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