chempirical

4-Trifluoromethylbenzoic anhydride

C16H8F6O3CAS 25753-16-6362.23 g/mol

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Acid anhydrideAlkyl halide

Properties

Molecular formula
C16H8F6O3
Molar mass
362.23 g/mol
Exact mass
362.0378 Da
logP
4.72Crippen estimate
Polar surface area
43.4 Ų
H-bond donors / acceptors
0 / 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
25753-16-6
SMILES
C1=CC(=CC=C1C(=O)OC(=O)C2=CC=C(C=C2)C(F)(F)F)C(F)(F)F
InChIKey
FNAWJOBKLWLHTA-UHFFFAOYSA-N
InChI
InChI=1S/C16H8F6O3/c17-15(18,19)11-5-1-9(2-6-11)13(23)25-14(24)10-3-7-12(8-4-10)16(20,21)22/h1-8H

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Names and synonyms

1 names
  • 4-(Trifluoromethyl)benzoic anhydride

Work with 4-Trifluoromethylbenzoic anhydride

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

Methyl 4-(trifluoromethyl)benzoate2967-66-070 % similar Ethyl 4-trifluoromethylbenzoate583-02-864 % similar 4-(Trifluoromethyl)benzamide1891-90-359 % similar 4-(Trifluoromethyl)benzoyl fluoride368-94-557 % similar 4-(Trifluoromethyl)benzoyl chloride329-15-755 % similar 4-(Trifluoromethyl)benzoic acid455-24-355 % similar 4-(Trifluoromethyl)acetophenone709-63-755 % similar 4′-Trifluoromethylbenzophenone728-86-953 % similar

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

Elsewhere

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