4-Hydroxy-6-(trifluoromethyl)-3-quinolinecarboxylic acid
Properties
- Molecular formula
- C11H6F3NO3
- Molar mass
- 257.17 g/mol
- Exact mass
- 257.0300 Da
- logP
- 2.25Crippen estimate
- Polar surface area
- 70.2 Ų
- H-bond donors / acceptors
- 2 / 2
- Rotatable bonds
- 1
Hazards
Warning
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
49713-47-5SMILES
C1=CC2=C(C=C1C(F)(F)F)C(=O)C(=CN2)C(=O)OInChIKey
VUPSPASQZKLXMI-UHFFFAOYSA-NInChI
InChI=1S/C11H6F3NO3/c12-11(13,14)5-1-2-8-6(3-5)9(16)7(4-15-8)10(17)18/h1-4H,(H,15,16)(H,17,18)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 4-Hydroxy-6-(trifluoromethyl)quinoline-3-carboxylic acid
Work with 4-Hydroxy-6-(trifluoromethyl)-3-quinolinecarboxylic acid
Similar compounds
4-Hydroxy-6-(trifluoromethoxy)-3-quinolinecarboxylic acid175203-86-867 % similar
1,4-Dihydro-6-fluoro-4-oxoquinoline-3-carboxylic acid343-10-267 % similar
6-Bromo-4-hydroxyquinoline-3-carboxylic acid98948-95-964 % similar
6-Chloro-4-hydroxyquinoline-3-carboxylic acid35973-14-963 % similar
4-Hydroxy-6-methoxyquinoline-3-carboxylic acid28027-16-960 % similar
1,4-Dihydro-4-oxo-3-quinolinecarboxylic acid13721-01-259 % similar
4-(Trifluoromethyl)phthalic acid835-58-553 % similar
7-Chloro-4-hydroxyquinoline-3-carboxylic acid86-47-553 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.