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aniline; 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoic acid

aniline; 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoic acid

Systemtic Name:aniline; 3,3,3-tris(fluoranyl)-2-(trifluoromethyl)propanoic acid
Openeye Name:aniline; 3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid
CAS Name:aniline; 3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid
IUPAC Name:aniline; 3,3,3-trifluoro-2-(trifluoromethyl)propanoic acid
Traditional Name:phenylamine; 3,3,3-trifluoro-2-(trifluoromethyl)propionic acid
Formula: C10H9F6NO2
MolecularWeight: 289.174379
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N.C(C(=O)O)(C(F)(F)F)C(F)(F)F


Isomeric SMILES

C1=CC=C(C=C1)N.C(C(=O)O)(C(F)(F)F)C(F)(F)F


InChI

InChI=1S/C6H7N.C4H2F6O2/c7-6-4-2-1-3-5-6;5-3(6,7)1(2(11)12)4(8,9)10/h1-5H,7H2;1H,(H,11,12)


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