Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Butyrophenone, 4'-(1,3-dihydroxy-4,4,4-trifluoro-3-(trifluoromethyl)butyl)-3-hydroxy-4,4,4-trifluoro-3-(trifluoromethyl)-
RN: 101247-78-3
InChIKey: HEBKBNIPLXYMCJ-UHFFFAOYSA-N

Molecular Formula

  • C16-H12-F12-O4

Molecular Weight

  • 496.243
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

  • Butyrophenone, 4'-(1,3-dihydroxy-4,4,4-trifluoro-3-(trifluoromethyl)butyl)-3-hydroxy-4,4,4-trifluoro-3-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 101247-78-3

System Generated Number

  • 0101247783

Structure Descriptors

InChI

1S/C16H12F12O4/c17-13(18,19)11(31,14(20,21)22)5-9(29)7-1-2-8(4-3-7)10(30)6-12(32,15(23,24)25)16(26,27)28/h1-4,9,29,31-32H,5-6H2

InChIKey

HEBKBNIPLXYMCJ-UHFFFAOYSA-N

Smiles

C(C[C@@H](c1ccc(C(CC(C(F)(F)F)(C(F)(F)F)O)=O)cc1)O)(C(F)(F)F)(C(F)(F)F)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#09505,