5-Chloro-2-hydroxy-3-methylbenzaldehyde

C₈H₇ClO₂CAS 23602-63-3170.59 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Phenol

Properties

Molecular formula: C₈H₇ClO₂
Molar mass: 170.59 g/mol
Exact mass: 170.0135 Da
logP: 2.17Crippen estimate
Polar surface area: 37.3 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 5 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

23602-63-3

SMILES

Cc1cc(Cl)cc(C=O)c1O

InChIKey

NSKZAOKQZDLHGO-UHFFFAOYSA-N

InChI

InChI=1S/C8H7ClO2/c1-5-2-7(9)3-6(4-10)8(5)11/h2-4,11H,1H3

Weigh it out

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

Names and synonyms

4 names

Benzaldehyde, 5-chloro-2-hydroxy-3-methyl-
2,3-Cresotaldehyde, 5-chloro-
5-Chloro-3-methylsalicylaldehyde
5-Chloro-3-methyl-2-hydroxybenzaldehyde

Work with 5-Chloro-2-hydroxy-3-methylbenzaldehyde

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

3,5-Dichlorosalicylaldehyde90-60-864 % similar 4-Chloro-2,6-dimethylphenol1123-63-362 % similar 3-Bromo-5-chlorosalicylaldehyde19652-32-560 % similar 4-Chloro-2-methylbenzaldehyde40137-29-956 % similar 3-Methylsalicylaldehyde824-42-056 % similar 2,4-Dichloro-6-methylphenol1570-65-655 % similar 3,5-Dimethyl-4-hydroxybenzaldehyde2233-18-352 % similar Diformylcresol7310-95-452 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Methoxybenzoyl chloride100-07-2 Methyl 4-chlorobenzoate1126-46-1 4-Chloro-3-methoxybenzaldehyde13726-16-4 5′-Chloro-2′-hydroxyacetophenone1450-74-4 2-Chloro-3-methylbenzoic acid15068-35-6 4-(Chloromethyl)benzoic acid1642-81-5 3-Methoxybenzoyl chloride1711-05-3 (3-Chlorophenyl)acetic acid1878-65-5

Elsewhere

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