chempirical

2-Chloro-5-nitrobenzotrifluoride

C7H3ClF3NO2CAS 777-37-7225.55 g/mol

Open in Covalent MOL file
ON+O−ClFFF
Alkyl halideAryl halideNitro

Properties

Molecular formula
C7H3ClF3NO2
Molar mass
225.55 g/mol
Exact mass
224.9804 Da
Melting point
22 °C
Boiling point
232 °C
logP
3.27Crippen estimate
Polar surface area
43.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
1

Identifiers

CAS number
777-37-7
SMILES
O=[N+]([O-])c1ccc(Cl)c(C(F)(F)F)c1
InChIKey
HQROXDLWVGFPDE-UHFFFAOYSA-N
InChI
InChI=1S/C7H3ClF3NO2/c8-6-2-1-4(12(13)14)3-5(6)7(9,10)11/h1-3H

Weigh it out

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

Names and synonyms

11 names
  • Benzene, 1-chloro-4-nitro-2-(trifluoromethyl)-
  • Toluene, 2-chloro-α,α,α-trifluoro-5-nitro-
  • 1-Chloro-4-nitro-2-(trifluoromethyl)benzene
  • 4-Chloro-3-(trifluoromethyl)nitrobenzene
  • 2-(Trifluoromethyl)-4-nitrochlorobenzene
  • 3-(Trifluoromethyl)-4-chloronitrobenzene
  • 2-Chloro-α,α,α-trifluoro-5-nitrotoluene
  • 2-Chloro-5-nitro-1-trifluoromethylbenzene
  • 2-Chloro-5-nitrotrifluoromethylbenzene
  • NSC 9467
  • 1-Chloro-2-trifluoromethyl-4-nitrobenzene

Work with 2-Chloro-5-nitrobenzotrifluoride

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Same formula

5-Chloro-2-nitrobenzotrifluoride118-83-2 1-Chloro-2-nitro-4-(trifluoromethyl)benzene121-17-5 2-Chloro-1-nitro-3-(trifluoromethyl)benzene39974-35-1 3-Chloro-4-nitrobenzotrifluoride402-11-9

Elsewhere

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