2,6-Dichloro-3-nitrobenzaldehyde

C₇H₃Cl₂NO₃CAS 5866-97-7220.00 g/mol

Open in Covalent MOL file

Aldehyde Aryl halide Nitro

Properties

Molecular formula: C₇H₃Cl₂NO₃
Molar mass: 220.00 g/mol
Exact mass: 218.9490 Da
logP: 2.71Crippen estimate
Polar surface area: 60.2 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

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

5866-97-7

SMILES

C1=CC(=C(C(=C1[N+](=O)[O-])Cl)C=O)Cl

InChIKey

CQOQHGBSJIWOCA-UHFFFAOYSA-N

InChI

InChI=1S/C7H3Cl2NO3/c8-5-1-2-6(10(12)13)7(9)4(5)3-11/h1-3H

Weigh it out

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Work with 2,6-Dichloro-3-nitrobenzaldehyde

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-6-nitrobenzaldehyde6361-22-467 % similar 2,3,4-Trichloronitrobenzene17700-09-365 % similar 1,3-Dichloro-2-methyl-4-nitrobenzene29682-46-058 % similar 1,3-Dichloro-2-fluoro-4-nitrobenzene393-79-358 % similar 2,3,6-Trichlorobenzaldehyde4659-47-658 % similar 4-Chloro-3-nitrobenzaldehyde16588-34-456 % similar 2,3-Dichloronitrobenzene3209-22-156 % similar 2,6-Dichloro-3-nitrobenzonitrile5866-98-854 % similar

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

Same formula

2-Chloro-5-nitrobenzoyl chloride25784-91-2 4-Chloro-3-nitrobenzoyl chloride38818-50-7 2-Chloro-4-nitrobenzoyl chloride7073-36-1

Elsewhere

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