2,4-Dichloro-5-nitropyridine

C5H2Cl2N2O2CAS 4487-56-3192.98 g/mol

Open in Covalent MOL file
NClN+OO−Cl
Aryl halideNitro

Properties

Molecular formula
C5H2Cl2N2O2
Molar mass
192.98 g/mol
Exact mass
191.9493 Da
logP
2.30Crippen estimate
Polar surface area
56.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

Hazards

Danger
Acute Toxic (GHS06)Irritant (GHS07)

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
4487-56-3
SMILES
C1=C(C(=CN=C1Cl)[N+](=O)[O-])Cl
InChIKey
RZVJQUMDJUUBBF-UHFFFAOYSA-N
InChI
InChI=1S/C5H2Cl2N2O2/c6-3-1-5(7)8-2-4(3)9(10)11/h1-2H

Weigh it out

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

Work with 2,4-Dichloro-5-nitropyridine

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-methyl-5-nitropyridine23056-33-966 % similar 4-Chloro-5-nitropyridin-2-amine24484-96-666 % similar 2-Chloro-5-nitropyridin-4-amine2604-39-966 % similar 1,3-Dichloro-4,6-dinitrobenzene3698-83-758 % similar 2-Chloro-5-nitroisonicotinic acid907545-47-557 % similar 2,4,5-Trichloronitrobenzene89-69-056 % similar 4-Chloro-3-nitropyridine13091-23-154 % similar 2-Chloro-5-nitropyridine4548-45-251 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4,6-Dichloro-3-pyridazinecarboxylic acid1040246-87-4 2,6-Dichloro-3-nitropyridine16013-85-7 2,5-Dichloro-3-nitropyridine21427-62-3 2,3-Dichloro-5-nitropyridine22353-40-8 3,6-Dichloropyridazine-4-carboxylic acid51149-08-7 2,4-Dichloro-3-nitropyridine5975-12-2 3,5-Dichloro-2-nitropyridine610278-88-1 4,6-Dichloropyrimidine-5-carboxylic acid87600-98-4

Elsewhere

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