Flufenamic acid

C₁₄H₁₀F₃NO₂CAS 530-78-9281.23 g/mol

Open in Covalent MOL file

Alkyl halide Carboxylic acid Secondary amine

Properties

Molecular formula: C₁₄H₁₀F₃NO₂
Molar mass: 281.23 g/mol
Exact mass: 281.0664 Da
Melting point: 133.5 °C
pKa: 4.09
logP: 4.15Crippen estimate
Polar surface area: 49.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 3

Hazards

Danger

H301 Toxic if swallowed95.8% of notifiers
H315 Causes skin irritation96.7% of notifiers
H319 Causes serious eye irritation96.7% of notifiers
H335 May cause respiratory irritation38.3% of notifiers
H411 Toxic to aquatic life with long lasting effects28.3% of notifiers

Aggregated from 120 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P273, P280, P301+P316, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

530-78-9

SMILES

O=C(O)c1ccccc1Nc1cccc(C(F)(F)F)c1

InChIKey

LPEPZBJOKDYZAD-UHFFFAOYSA-N

InChI

InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20)

Weigh it out

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

Names and synonyms

31 names · show all

Benzoic acid, 2-[[3-(trifluoromethyl)phenyl]amino]-
Anthranilic acid, N-(α,α,α-trifluoro-m-tolyl)-
2-[[3-(Trifluoromethyl)phenyl]amino]benzoic acid
INF 1837
Arlef
Fluphenamic acid
N-(m-Trifluoromethylphenyl)-2-aminobenzoic acid
N-(α,α,α-Trifluoro-m-tolyl)anthranilic acid
N-[3-(Trifluoromethyl)phenyl]anthranilic acid
3′-Trifluoromethyldiphenylamine-2-carboxylic acid
Achless
Fullsafe
Paraflu
Parlef
Surika
Tecramine
ANT-1
Parlif
Plostene
3′-Trifluoromethyl-N-phenylanthranilic acid
Pinox
Movilizin
2-[3-(Trifluoromethyl)anilino]benzoic acid
Ristogen
NSC 82699
Ansatin
Meralen
CI 440
CN 27544
Sastridex
NSC 219007

Work with Flufenamic 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

Niflumic acid4394-00-767 % similar 2-((3-Chlorophenyl)amino)benzoic acid13278-36-964 % similar Fenamic acid91-40-763 % similar Etofenamate30544-47-957 % similar Ufenamate67330-25-056 % similar 3-(Trifluoromethyl)benzoic acid454-92-253 % similar 4-(Trifluoromethyl)phthalic acid835-58-551 % similar Lobenzarit63329-53-351 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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