3,5-Dichloro-4-hydroxybenzaldehyde

C₇H₄Cl₂O₂CAS 2314-36-5191.01 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₇H₄Cl₂O₂
Molar mass: 191.01 g/mol
Exact mass: 189.9588 Da
logP: 2.51Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

2314-36-5

SMILES

C1=C(C=C(C(=C1Cl)O)Cl)C=O

InChIKey

LIYGCLJYTHRBQV-UHFFFAOYSA-N

InChI

InChI=1S/C7H4Cl2O2/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.

Work with 3,5-Dichloro-4-hydroxybenzaldehyde

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

3-Chloro-4-hydroxy-5-methoxybenzaldehyde19463-48-066 % similar 3-Chloro-4-hydroxybenzaldehyde2420-16-857 % similar 3,4,5-Trihydroxybenzaldehyde13677-79-756 % similar 3,4-Dichlorobenzaldehyde6287-38-354 % similar 3-Chloro-2-hydroxy-benzaldehyde1927-94-253 % similar 3,5-Difluoro-4-hydroxybenzaldehyde118276-06-552 % similar 4-Hydroxy-3,5-diiodobenzaldehyde1948-40-952 % similar 3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-352 % similar

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

Same formula

2,6-Dichlorobenzoic acid50-30-6 2,3-Dichlorobenzoic acid50-45-3 2,5-Dichlorobenzoic acid50-79-3 2,4-Dichlorobenzoic acid50-84-0 3,5-Dichlorobenzoic acid51-36-5 3,4-Dichlorobenzoic acid51-44-5 3,5-Dichlorosalicylaldehyde90-60-8

Elsewhere

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