5-Bromo-2-chloro-4-methyl-3-nitropyridine

C₆H₄BrClN₂O₂CAS 884495-15-2251.46 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₆H₄BrClN₂O₂
Molar mass: 251.46 g/mol
Exact mass: 249.9145 Da
logP: 2.71Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed66.7% of notifiers
H312 Harmful in contact with skin66.7% of notifiers
H315 Causes skin irritation100% of notifiers
H319 Causes serious eye irritation100% of notifiers
H332 Harmful if inhaled66.7% of notifiers
H335 May cause respiratory irritation100% of notifiers

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number

884495-15-2

SMILES

Cc1c(Br)cnc(Cl)c1[N+](=O)[O-]

InChIKey

BLJOCKNDWUTFEN-UHFFFAOYSA-N

InChI

InChI=1S/C6H4BrClN2O2/c1-3-4(7)2-9-6(8)5(3)10(11)12/h2H,1H3

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Names and synonyms

1 names

Pyridine, 5-bromo-2-chloro-4-methyl-3-nitro-

Work with 5-Bromo-2-chloro-4-methyl-3-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-Amino-5-bromo-4-methyl-3-nitropyridine100367-40-665 % similar 5-Bromo-2-methoxy-4-methyl-3-nitropyridine884495-14-162 % similar 3-Bromo-2-chloro-5-nitropyridine5470-17-754 % similar 4,6-Dichloro-5-nitropyrimidine4316-93-251 % similar 3-Bromo-4-methyl-5-nitropyridine69872-15-751 % similar 2-Chloro-4-methyl-3-nitropyridine23056-39-550 % similar 5-Bromo-2-hydroxy-3-nitro-4-picoline228410-90-048 % similar 2-Chloro-3-methyl-5-nitropyridine22280-56-447 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Bromo-6-chloro-2-methyl-5-nitropyridine186413-75-2 2-Bromo-4-chloro-6-nitrobenzenamine827-25-8 3-Bromo-2-chloro-6-methyl-5-nitropyridine856834-95-2 2-Bromo-6-chloro-4-nitroaniline99-29-6

Elsewhere

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