N-(2-Chloro-4-(trifluoromethyl)phenyl)acetamide

C₉H₇ClF₃NOCAS 247170-19-0237.61 g/mol

Open in Covalent MOL file

Alkyl halide Amide Aryl halide

Properties

Molecular formula: C₉H₇ClF₃NO
Molar mass: 237.61 g/mol
Exact mass: 237.0168 Da
logP: 3.32Crippen estimate
Polar surface area: 29.1 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 1

Identifiers

CAS number

247170-19-0

SMILES

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

InChIKey

QRMZQPODCUCPQD-UHFFFAOYSA-N

InChI

InChI=1S/C9H7ClF3NO/c1-5(15)14-8-3-2-6(4-7(8)10)9(11,12)13/h2-4H,1H3,(H,14,15)

Weigh it out

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

Names and synonyms

1 names

2-Chloro-4-(trifluoromethyl)acetanilide

Work with N-(2-Chloro-4-(trifluoromethyl)phenyl)acetamide

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-Acetamido-3-chlorobenzenesulfonyl chloride16761-18-553 % similar 3',5'-Bis(trifluoromethyl)acetanilide16143-84-353 % similar 3,4-Dichlorobenzotrifluoride328-84-749 % similar N-(4-Chloro-2-(trifluoromethoxy)phenyl)acetamide175278-36-148 % similar 2-Chloro-4-trifluoromethylbenzoic acid23228-45-748 % similar 1-[2,6-Dichloro-4-(trifluoromethyl)phenyl]ethanone175205-88-648 % similar 3-Chloro-4-iodobenzotrifluoride141738-80-948 % similar 1-(2-Chloro-5-(trifluoromethyl)phenyl)thiourea21714-35-246 % similar

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

Same formula

N-(Chloroacetyl)-4-(trifluoromethyl)aniline2707-23-5 2-Chloro-N-[3-(trifluoromethyl)phenyl]acetamide351-38-2 N-(Chloroacetyl)-2-(trifluoromethyl)aniline3792-04-9

Elsewhere

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