chempirical

2,3,5,6-Tetrafluoro-4-aminobenzotrifluoride

C7H2F7NCAS 651-83-2233.09 g/mol

Open in Covalent MOL file
FFNH2FFFFF
Alkyl halideAryl halidePrimary amine

Properties

Molecular formula
C7H2F7N
Molar mass
233.09 g/mol
Exact mass
233.0075 Da
logP
2.84Crippen estimate
Polar surface area
26.0 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

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
651-83-2
SMILES
C1(=C(C(=C(C(=C1F)F)N)F)F)C(F)(F)F
InChIKey
FJOACTZFMHZHSC-UHFFFAOYSA-N
InChI
InChI=1S/C7H2F7N/c8-2-1(7(12,13)14)3(9)5(11)6(15)4(2)10/h15H2

Weigh it out

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

Names and synonyms

1 names
  • 2,3,5,6-Tetrafluoro-4-trifluoromethylaniline

Work with 2,3,5,6-Tetrafluoro-4-aminobenzotrifluoride

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

Perfluorotoluene434-64-065 % similar 2,3,5,6-Tetrafluoro-1,4-benzenediamine1198-64-758 % similar Pentafluoroaniline771-60-855 % similar 4-Bromo-2,3,5,6-tetrafluorobenzotrifluoride17823-46-054 % similar [2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenyl]hydrazine1868-85-554 % similar 2,4,5,6-Tetrafluoro-1,3-benzenediamine1198-63-652 % similar 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)phenol2787-79-352 % similar 2,3,5,6-Tetrafluoro-4-(trifluoromethyl)benzenethiol651-84-352 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook