2,6-Dichloropyridine-4-carboxaldehyde

C₆H₃Cl₂NOCAS 113293-70-2176.00 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide

Properties

Molecular formula: C₆H₃Cl₂NO
Molar mass: 176.00 g/mol
Exact mass: 174.9592 Da
logP: 2.20Crippen estimate
Polar surface area: 30.0 Å²
H-bond donors / acceptors: 0 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed100% of notifiers
H317 May cause an allergic skin reaction95.3% of notifiers
H319 Causes serious eye irritation100% of notifiers

Aggregated from 43 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P333+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

113293-70-2

SMILES

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

InChIKey

MVCMPKYZHKUBCL-UHFFFAOYSA-N

InChI

InChI=1S/C6H3Cl2NO/c7-5-1-4(3-10)2-6(8)9-5/h1-3H

Weigh it out

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

Names and synonyms

1 names

2,6-Dichloropyridine-4-carbaldehyde

Work with 2,6-Dichloropyridine-4-carboxaldehyde

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

2-Chloro-4-pyridinecarboxaldehyde101066-61-957 % similar 1,3,5-Benzenetricarboxaldehyde3163-76-652 % similar 3,5-Dichlorobenzaldehyde10203-08-452 % similar 2-Chloropyridine-5-carbaldehyde23100-12-148 % similar 2,4,6-Trichloropyridine16063-69-746 % similar 3,5-Dichloro-4-hydroxybenzaldehyde2314-36-545 % similar 6-Chloropyridine-2-carbaldehyde54087-03-545 % similar 2-Chloropyrimidine-5-carbaldehyde933702-55-744 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4,6-Dichloropyridine-3-carbaldehyde1060811-62-2 2,4-Dichloropyridine-3-carbaldehyde134031-24-6 3,5-Dichloro-4-formyl pyridine136590-83-5 2,5-Dichloro-pyridine-3-carbaldehyde176433-49-1 2-Chloronicotinoyl chloride49609-84-9 2,6-Dichloro-3-pyridinecarboxaldehyde55304-73-9 6-Chloronicotinoyl chloride58757-38-3 2-Chloropyridine-4-carbonyl chloride65287-34-5

Elsewhere

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