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Substance Name: Benzoic acid, 5-amino-2-(2-hydroxy-1,1,1,3,3,3-hexafluoro-2-propyl)-
RN: 100811-91-4
InChIKey: ATYXPTXSXDFIEM-UHFFFAOYSA-N

Molecular Formula

  • C10-H7-F6-N-O3

Molecular Weight

  • 303.157
 
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Names and Synonyms

Synonyms

  • 5-Amino-2((1-hydroxy-2,2,2-trifluoro-1-trifluoromethyl)ethyl)benzoic acid
  • 5-Amino-2-(2-hydroxy-1,1,1,3,3,3-hexafluoro-2-propyl)benzoic acid

Systematic Name

  • Benzoic acid, 5-amino-2-(2-hydroxy-1,1,1,3,3,3-hexafluoro-2-propyl)-

Registry Numbers

CAS Registry Number

  • 100811-91-4

System Generated Number

  • 0100811914

Structure Descriptors

InChI

1S/C10H7F6NO3/c11-9(12,13)8(20,10(14,15)16)6-2-1-4(17)3-5(6)7(18)19/h1-3,20H,17H2,(H,18,19)

InChIKey

ATYXPTXSXDFIEM-UHFFFAOYSA-N

Smiles

c1(C(C(F)(F)F)(C(F)(F)F)O)c(cc(N)cc1)C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08663,