6-Bromoimidazo[1,2-a]pyridine-3-carboxylic acid

C₈H₅BrN₂O₂CAS 944896-42-8241.04 g/mol

Open in Covalent MOL file

Aryl halide Carboxylic acid

Properties

Molecular formula: C₈H₅BrN₂O₂
Molar mass: 241.04 g/mol
Exact mass: 239.9534 Da
logP: 1.79Crippen estimate
Polar surface area: 54.6 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Hazards

Warning

H319 Causes serious eye irritation98.6% of notifiers

Aggregated from 69 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264+P265, P280, P305+P351+P338, P337+P317

Identifiers

CAS number

944896-42-8

SMILES

C1=CC2=NC=C(N2C=C1Br)C(=O)O

InChIKey

SDKJLYHPCBMDAD-UHFFFAOYSA-N

InChI

InChI=1S/C8H5BrN2O2/c9-5-1-2-7-10-3-6(8(12)13)11(7)4-5/h1-4H,(H,12,13)

Weigh it out

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Names and synonyms

1 names

6-Bromoimidazo[1,2-A]pyridine-3-carboxylicacid

Work with 6-Bromoimidazo[1,2-a]pyridine-3-carboxylic acid

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

Imidazo(1,2-a)pyridine-3-carboxylic acid6200-60-856 % similar Ethyl 6-bromoimidazo[1,2-a]pyridine-3-carboxylate372198-69-156 % similar 5-Bromopyridine-2-carboxylic acid30766-11-153 % similar 3-Bromoimidazo[1,2-a]pyridine-6-carboxylic acid886362-00-152 % similar 5-Bromopyrimidine-2-carboxylic acid37131-87-645 % similar 4-Bromopyridine-2-carboxylic acid30766-03-144 % similar 4-Bromobenzoic acid586-76-543 % similar 5-Bromo-1,2-dihydro-2-oxo-3-pyridinecarboxylic acid104612-36-442 % similar

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

Same formula

5-Bromo-1H-indazole-3-carboxylic acid1077-94-7 4-Benzyl-10,19-diethyl-4,10,19-triaza-1,7,13,16-tetraoxacycloheneicosane397864-11-8 6-Bromo-1H-indazole-3-carboxylic acid660823-36-9 6-Bromoimidazo(1,2-a)pyridine-2-carboxylic acid749849-14-7 5-Bromo-1H-pyrrolo[2,3-B]pyridine-3-carboxylic acid849068-61-7 6-Bromoh-pyrazolo[1,5-A]pyridine-2-carboxylic acid876379-74-7 6-Bromo-2,4(1H,3H)-quinazolinedione88145-89-5 4-Bromo-1H-indazole-3-carboxylic acid885521-80-2

Elsewhere

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