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3-[4-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid

Chemical Structure Depiction of
3-[4-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Available: 2 mg
Amount:
mg
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$83.09
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Compound characteristics

Compound ID: 5618-0035
Compound Name: 3-[4-{[5-(2-nitrophenyl)furan-2-yl]methylidene}-5-oxo-3-(trifluoromethyl)-4,5-dihydro-1H-pyrazol-1-yl]benzoic acid
Molecular Weight: 471.35
Molecular Formula: C22 H12 F3 N3 O6
Smiles: C(=C1/C(C(F)(F)F)=NN(C1=O)c1cccc(c1)C(O)=O)\c1ccc(c2ccccc2[N+]([O-])=O)o1
Stereo: ACHIRAL
logP: 4.6546
logD: 1.7688
logSw: -4.6125
Hydrogen bond acceptors count: 11
Hydrogen bond donors count: 1
Polar surface area: 95.472
InChI Key: RMOGKOXPAXDADB-UHFFFAOYSA-N
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