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Substance Name: 4-(3-Trifluoromethyldiazirino)benzoic acid
RN: 85559-46-2
InChIKey: CZPAJVBVULSLGG-UHFFFAOYSA-N

Molecular Formula

  • C9-H5-F3-N2-O2

Molecular Weight

  • 230.145
 
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Names and Synonyms

Name of Substance

  • 4-(3-Trifluoromethyldiazirino)benzoic acid

Synonyms

  • 4-(1-Azi-2,2,2-trifluoroethyl)benzoate
  • 4-Atfeb
  • TDBA

Systematic Name

  • Benzoic acid, 4-(3-(trifluoromethyl)-3H-diazirin-3-yl)-

Registry Numbers

CAS Registry Number

  • 85559-46-2

System Generated Number

  • 0085559462

Structure Descriptors

InChI

1S/C9H5F3N2O2/c10-9(11,12)8(13-14-8)6-3-1-5(2-4-6)7(15)16/h1-4H,(H,15,16)

InChIKey

CZPAJVBVULSLGG-UHFFFAOYSA-N

Smiles

C(c1ccc(cc1)C1(N=N1)C(F)(F)F)(=O)O