4-Hydroxy-3,5-diiodobenzaldehyde

C₇H₄I₂O₂CAS 1948-40-9373.92 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₄I₂O₂
Molar mass: 373.92 g/mol
Exact mass: 373.8301 Da
Melting point: 200–201 °C
logP: 2.41Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

1948-40-9

SMILES

O=Cc1cc(I)c(O)c(I)c1

InChIKey

WHLUEIMENHLCMY-UHFFFAOYSA-N

InChI

InChI=1S/C7H4I2O2/c8-5-1-4(3-10)2-6(9)7(5)11/h1-3,11H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names

Benzaldehyde, 4-hydroxy-3,5-diiodo-
3,5-Diiodo-4-hydroxybenzaldehyde
NSC 72943

Work with 4-Hydroxy-3,5-diiodobenzaldehyde

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

4-Hydroxy-3-iodo-5-methoxybenzaldehyde5438-36-866 % similar 3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-357 % similar 3,4,5-Trihydroxybenzaldehyde13677-79-756 % similar 3,5-Difluoro-4-hydroxybenzaldehyde118276-06-552 % similar 3,5-Dibromo-4-hydroxybenzaldehyde2973-77-552 % similar 2,4,6-Triiodophenol609-23-450 % similar 3,5-Dihydroxybenzaldehyde26153-38-848 % similar 3,5-Di-tert-butyl-4-hydroxybenzaldehyde1620-98-047 % similar

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

Same formula

2,5-Diiodobenzoic acid14192-12-2 3,5-Diiodobenzoic acid19094-48-5 3,5-Diiodosalicylaldehyde2631-77-8

Elsewhere

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