2-Bromo-5-chloro-3-nitropyridine

C₅H₂BrClN₂O₂CAS 75806-86-9237.44 g/mol

Open in Covalent MOL file

Aryl halide Nitro

Properties

Molecular formula: C₅H₂BrClN₂O₂
Molar mass: 237.44 g/mol
Exact mass: 235.8988 Da
logP: 2.41Crippen estimate
Polar surface area: 56.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

Danger

H302 Harmful if swallowed100% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage95% of notifiers

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P354+P338, P317, P321, P330, P332+P317, P362+P364, P501

Identifiers

CAS number

75806-86-9

SMILES

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

InChIKey

VFMIDVIAQMFGGP-UHFFFAOYSA-N

InChI

InChI=1S/C5H2BrClN2O2/c6-5-4(9(10)11)1-3(7)2-8-5/h1-2H

Weigh it out

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

Work with 2-Bromo-5-chloro-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

2,5-Dibromo-3-nitropyridine15862-37-066 % similar 2,5-Dichloro-3-nitropyridine21427-62-366 % similar 2-Bromo-5-fluoro-3-nitropyridine652160-72-064 % similar 5-Chloro-2-methyl-3-nitropyridine1211533-93-562 % similar 2-Amino-5-chloro-3-nitropyridine409-39-262 % similar 2-Amino-5-chloro-3-nitropyridine5409-39-262 % similar 5-Chloro-2-fluoro-3-nitropyridine60186-16-562 % similar 5-Chloro-3-nitropyridine-2-carbonitrile181123-11-557 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Bromo-4-chloro-5-nitropyridine31872-63-6 3-Bromo-2-chloro-5-nitropyridine5470-17-7 5-Bromo-2-chloro-3-nitropyridine67443-38-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook