chempirical

2-Methyl-quinoline-4-carboxylic acid

C11H9NO2CAS 634-38-8187.20 g/mol

Open in Covalent MOL file
NOOH
Carboxylic acid

Properties

Molecular formula
C11H9NO2
Molar mass
187.20 g/mol
Exact mass
187.0633 Da
logP
2.24Crippen estimate
Polar surface area
50.2 Ų
H-bond donors / acceptors
1 / 2
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
634-38-8
SMILES
CC1=NC2=CC=CC=C2C(=C1)C(=O)O
InChIKey
UIDHNPTVQFNWOJ-UHFFFAOYSA-N
InChI
InChI=1S/C11H9NO2/c1-7-6-9(11(13)14)8-4-2-3-5-10(8)12-7/h2-6H,1H3,(H,13,14)

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Names and synonyms

1 names
  • 2-Methylquinoline-4-carboxylic acid

Work with 2-Methyl-quinoline-4-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

Bicinchoninic acid1245-13-269 % similar 2-Hydroxycinchoninic acid15733-89-866 % similar 2-Chloro-4-quinolinecarboxylic acid5467-57-264 % similar 2-(4-Methylphenyl)-4-quinolinecarboxylic acid20389-05-363 % similar 2-(2-Chlorophenyl)-4-quinolinecarboxylic acid20389-09-757 % similar 2-(4-Hydroxyphenyl)quinoline-4-carboxylic acid6952-34-757 % similar 2-(4-Bromo-phenyl)-quinoline-4-carboxylic acid103914-52-956 % similar 2-Thiophen-2-yl-quinoline-4-carboxylic acid31792-47-956 % similar

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

Same formula

2-(1H-Pyrrol-1-yl)benzoic acid10333-68-3 6-Amino-2-naphthoic acid116668-47-4 Indole-3-acrylic acid1204-06-4 Benzylmaleimide1631-26-1 N-(4-Methylphenyl)maleimide1631-28-3 4-(1H-Pyrrol-1-yl)benzoic acid22106-33-8 1-Acetylindole-3-carboxaldehyde22948-94-3 8-Acetoxyquinoline2598-29-0

Elsewhere

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