chempirical

Quinoxaline-5-carboxylic acid

C9H6N2O2CAS 6924-66-9174.16 g/mol

Open in Covalent MOL file
NNOOH
Carboxylic acid

Properties

Molecular formula
C9H6N2O2
Molar mass
174.16 g/mol
Exact mass
174.0429 Da
logP
1.33Crippen estimate
Polar surface area
63.1 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
6924-66-9
SMILES
C1=CC(=C2C(=C1)N=CC=N2)C(=O)O
InChIKey
QLZNISOPACYKOR-UHFFFAOYSA-N
InChI
InChI=1S/C9H6N2O2/c12-9(13)6-2-1-3-7-8(6)11-5-4-10-7/h1-5H,(H,12,13)

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Work with Quinoxaline-5-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

8-Quinolinecarboxylic acid86-59-965 % similar Quinoline-5-carboxylic acid7250-53-563 % similar 1-Phenazinecarboxylic acid2538-68-360 % similar 4-Quinolinecarboxylic acid486-74-856 % similar 2,2'-Bipyridine-3,3'-dicarboxylic acid4433-01-655 % similar 2-Chloronicotinic acid2942-59-853 % similar 2-Aminonicotinic acid5345-47-153 % similar 1H-Benzoimidazole-4-carboxylic acid46006-36-453 % similar

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

Same formula

1,6-Naphthyridine-2-carboxylic acid197507-59-8 5-Nitroso-8-hydroxyquinoline3565-26-2 4-Nitroisoquinoline36073-93-5 Toluene diisocyanate584-84-9 5-Nitroisoquinoline607-32-9 5-Nitroquinoline607-34-1 8-Nitroquinoline607-35-2 6-Nitroquinoline613-50-3

Elsewhere

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