Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2,4-Pentanediol, 4-(p-tolyl)-1,1,1-trifluoro-2-(trifluoromethyl)-
RN: 101931-59-3
InChIKey: JHEVMLMNUBLWIU-UHFFFAOYSA-N

Molecular Formula

  • C13-H14-F6-O2

Molecular Weight

  • 316.2396
 
* 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

Synonym

  • 4-(p-Tolyl)-1,1,1-trifluoro-2-trifluoromethyl-2,4-pentanediol

Systematic Name

  • 2,4-Pentanediol, 4-(p-tolyl)-1,1,1-trifluoro-2-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 101931-59-3

System Generated Number

  • 0101931593

Structure Descriptors

InChI

1S/C13H14F6O2/c1-8-3-5-9(6-4-8)10(2,20)7-11(21,12(14,15)16)13(17,18)19/h3-6,20-21H,7H2,1-2H3

InChIKey

JHEVMLMNUBLWIU-UHFFFAOYSA-N

Smiles

Cc1ccc(cc1)C(C)(CC(C(F)(F)F)(C(F)(F)F)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#08891,