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Substance Name: 1-Propanol, 1-ethoxy-2,2,3,3,3-pentafluoro-, p-toluenesulfonate
RN: 31185-48-5
InChIKey: ZGRJEYBQEBLZGJ-UHFFFAOYSA-N

Molecular Formula

  • C12-H13-F5-O4-S

Molecular Weight

  • 348.287
 
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Names and Synonyms

Synonyms

  • 1-Ethoxy-2,2,3,3,3-pentafluoro-1-propanol p-toluenesulfonate
  • 1-Ethoxy-2,2,3,3,3-pentafluoropropyl-p-toluenesulfonic acid
  • 2,2,3,3,3-Pentafluoro-1-ethoxy-1-tosyloxypropane
  • BRN 2770535
  • p-Toluenesulfonic acid, (1-ethoxy-2,2,3,3,3-pentafluoro)propyl ester

Systematic Name

  • 1-Propanol, 1-ethoxy-2,2,3,3,3-pentafluoro-, p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 31185-48-5

System Generated Number

  • 0031185485

Structure Descriptors

InChI

1S/C12H13F5O4S/c1-3-20-10(11(13,14)12(15,16)17)21-22(18,19)9-6-4-8(2)5-7-9/h4-7,10H,3H2,1-2H3

InChIKey

ZGRJEYBQEBLZGJ-UHFFFAOYSA-N

Smiles

C([C@@H](OCC)OS(=O)(=O)c1ccc(cc1)C)(C(F)(F)F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 580mg/kg (580mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1212, 1970.