5-Bromo-6-chloropyridine-3-carboxylic acid

C₆H₃BrClNO₂CAS 29241-62-1236.45 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid

Properties

Molecular formula: C₆H₃BrClNO₂
Molar mass: 236.45 g/mol
Exact mass: 234.9036 Da
logP: 2.20Crippen estimate
Polar surface area: 50.2 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H302 Harmful if swallowed88.9% of notifiers
H315 Causes skin irritation11.1% of notifiers
H319 Causes serious eye irritation11.1% of notifiers

Aggregated from 45 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+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number

29241-62-1

SMILES

C1=C(C=NC(=C1Br)Cl)C(=O)O

InChIKey

DXEUARPQHJXMII-UHFFFAOYSA-N

InChI

InChI=1S/C6H3BrClNO2/c7-4-1-3(6(10)11)2-9-5(4)8/h1-2H,(H,10,11)

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Names and synonyms

1 names

5-Bromo-6-chloronicotinic acid

Work with 5-Bromo-6-chloropyridine-3-carboxylic acid

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Similar compounds

5,6-Dichloronicotinic acid41667-95-266 % similar 6-Chloro-5-fluoropyridine-3-carboxylic acid38186-86-662 % similar 2-Chloro-3-nitro-5-pyridinecarboxylic acid7477-10-359 % similar Methyl 5-bromo-6-chloropyridine-3-carboxylate78686-77-857 % similar 2-Chloropyrimidine-5-carboxylic acid374068-01-653 % similar 3-Bromo-4-chlorobenzoic acid42860-10-653 % similar 3,5-Dibromo-4-hydroxybenzoic acid3337-62-050 % similar 6-Bromo-5-fluoro-3-pyridinecarboxylic acid38186-87-750 % similar

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

Same formula

4-Bromo-1-chloro-2-nitrobenzene16588-24-2 2-Bromo-1-chloro-4-nitrobenzene16588-26-4 2-Bromo-1-chloro-3-nitrobenzene19128-48-4 1-Bromo-3-chloro-5-nitrobenzene219817-43-3 5-Bromo-2-chloronicotinic acid29241-65-4 1-Bromo-2-chloro-4-nitrobenzene29682-39-1 1-Bromo-2-chloro-3-nitrobenzene3970-37-4 1-Bromo-4-chloro-2-nitrobenzene41513-04-6

Elsewhere

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