chempirical

2-Fluoro-5-(trifluoromethyl)benzamide

C8H5F4NOCAS 207919-05-9207.13 g/mol

Open in Covalent MOL file
FFFONH2F
Alkyl halideAmideAryl halide

Properties

Molecular formula
C8H5F4NO
Molar mass
207.13 g/mol
Exact mass
207.0307 Da
logP
1.94Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Identifiers

CAS number
207919-05-9
SMILES
C1=CC(=C(C=C1C(F)(F)F)C(=O)N)F
InChIKey
DDLPGTOHZZKQLP-UHFFFAOYSA-N
InChI
InChI=1S/C8H5F4NO/c9-6-2-1-4(8(10,11)12)3-5(6)7(13)14/h1-3H,(H2,13,14)

Weigh it out

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

Work with 2-Fluoro-5-(trifluoromethyl)benzamide

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

4-(Trifluoromethyl)benzamide1891-90-355 % similar 1,2-Difluoro-4-(trifluoromethyl)benzene32137-19-253 % similar [2-Fluoro-4-(trifluoromethyl)phenyl]phenylmethanone207974-08-149 % similar 3-Chloro-4-fluorobenzotrifluoride78068-85-647 % similar 2,5-Bis(trifluoromethyl)benzoic acid42580-42-745 % similar 4-Fluoro-3-nitrobenzotrifluoride367-86-244 % similar 2-Amino-4-(trifluoromethyl)benzoic acid402-13-144 % similar 2,6-Dichloro-4-(trifluoromethyl)benzamide157021-70-044 % similar

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

Same formula

2-Fluoro-6-(trifluoromethyl)benzamide144851-59-2 2-Fluoro-3-(trifluoromethyl)benzamide207853-60-9 2-Fluoro-4-(trifluoromethyl)benzamide207853-64-3 4-Fluoro-2-(trifluoromethyl)benzamide207919-06-0 3-Fluoro-5-(trifluoromethyl)benzamide207986-20-7 4-Fluoro-3-(trifluoromethyl)benzamide67515-57-5

Elsewhere

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