3',5'-Bis(trifluoromethyl)acetanilide

C₁₀H₇F₆NOCAS 16143-84-3271.16 g/mol

Open in Covalent MOL file

Alkyl halide Amide

Properties

Molecular formula: C₁₀H₇F₆NO
Molar mass: 271.16 g/mol
Exact mass: 271.0432 Da
logP: 3.68Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

16143-84-3

SMILES

CC(=O)NC1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F

InChIKey

XMKZELXFBZUGEY-UHFFFAOYSA-N

InChI

InChI=1S/C10H7F6NO/c1-5(18)17-8-3-6(9(11,12)13)2-7(4-8)10(14,15)16/h2-4H,1H3,(H,17,18)

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Names and synonyms

1 names

3,5-Bis(trifluoromethyl)acetanilide

Work with 3',5'-Bis(trifluoromethyl)acetanilide

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

N-(2-Chloro-4-(trifluoromethyl)phenyl)acetamide247170-19-053 % similar 1-[3,5-Bis(trifluoromethyl)phenyl]-2-thiourea175277-17-551 % similar Bis (trifluoromethyl)acetophenone30071-93-350 % similar 4'-tert-Butylacetanilide20330-45-447 % similar [3,5-Bis(trifluoromethyl)phenyl]hydrazine886-35-147 % similar 3,3',5,5'-Tetrakis(trifluoromethyl)benzophenone175136-66-045 % similar Methyl 3,5-bistrifluoromethylbenzoate26107-80-242 % similar 1-[3,5-Bis(trifluoromethyl)phenyl]-1-propanone85068-34-442 % similar

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

Elsewhere

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