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Substance Name: 1,3-Butanediol, 1-(p-fluorophenyl)-2-methyl-4,4,4-trifluoro-3-(trifluoromethyl)-, 3,4-dichlorocarbanilate
RN: 100991-90-0
InChIKey: DYNXBYHYGGWRKH-UHFFFAOYSA-N

Molecular Formula

  • C19-H14-Cl2-F7-N-O3

Molecular Weight

  • 508.216
 
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Names and Synonyms

  • 1,3-Butanediol, 1-(p-fluorophenyl)-2-methyl-4,4,4-trifluoro-3-(trifluoromethyl)-, 3,4-dichlorocarbanilate

Registry Numbers

CAS Registry Number

  • 100991-90-0

System Generated Number

  • 0100991900

Structure Descriptors

InChI

1S/C19H14Cl2F7NO3/c1-9(15(30)10-2-4-11(22)5-3-10)17(18(23,24)25,19(26,27)28)32-16(31)29-12-6-7-13(20)14(21)8-12/h2-9,15,30H,1H3,(H,29,31)

InChIKey

DYNXBYHYGGWRKH-UHFFFAOYSA-N

Smiles

C([C@@H]([C@@H](c1ccc(F)cc1)O)C)(OC(Nc1cc(c(Cl)cc1)Cl)=O)(C(F)(F)F)C(F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 42mg/kg (42mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08982,