chempirical

2-(4-Hydroxyphenyl)quinoline-4-carboxylic acid

C16H11NO3CAS 6952-34-7265.27 g/mol

Open in Covalent MOL file
NOHOOH
Carboxylic acidPhenol

Properties

Molecular formula
C16H11NO3
Molar mass
265.27 g/mol
Exact mass
265.0739 Da
logP
3.31Crippen estimate
Polar surface area
70.4 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
2

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
6952-34-7
SMILES
C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=C(C=C3)O)C(=O)O
InChIKey
KXZJHVJKXJLBKO-UHFFFAOYSA-N
InChI
InChI=1S/C16H11NO3/c18-11-7-5-10(6-8-11)15-9-13(16(19)20)12-3-1-2-4-14(12)17-15/h1-9,18H,(H,19,20)

Weigh it out

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

Work with 2-(4-Hydroxyphenyl)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

2-(4-Bromo-phenyl)-quinoline-4-carboxylic acid103914-52-979 % similar 2-(4-Methylphenyl)-4-quinolinecarboxylic acid20389-05-374 % similar 2-(4-Chloro-phenyl)-quinoline-4-carboxylic acid5466-31-974 % similar Bicinchoninic acid1245-13-274 % similar 2-(4-Methoxyphenyl)quinoline-4-carboxylic acid4364-02-770 % similar 2-(3-Chlorophenyl)-4-quinolinecarboxylic acid20389-10-065 % similar 2-(3-Bromophenyl)quinoline-4-carboxylic acid298230-83-864 % similar 6-Bromo-2-phenyl-quinoline-4-carboxylic acid33007-99-763 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook