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Substance Name: Trifluoroacetaldehyde hydrate
RN: 421-53-4
InChIKey: VGJWVEYTYIBXIA-UHFFFAOYSA-N

Classification Codes

  • Agricultural Chemical
  • Drug / Therapeutic Agent
  • Fungicide, Bactericide, Wood Preservative
  • Mutation Data

Molecular Formula

  • C2-H3-F3-O2

Molecular Weight

  • 116.038
 
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Names and Synonyms

Name of Substance

  • Trifluoroacetaldehyde hydrate

Synonyms

  • 2,2,2-Trifluoro-1,1-ethanediol
  • 2,2,2-Trifluoroacetaldehyde hydrate
  • 4-01-00-03133 (Beilstein Handbook Reference)
  • Acetaldehyde, trifluoro-, hydrate
  • BRN 1736686
  • EINECS 207-006-4
  • Fluoral, hydrate
  • NSC 146025
  • Tfaih
  • Trifluoroacetaldehyde hydrate

Systematic Names

  • 1,1-Ethanediol, 2,2,2-trifluoro-
  • 2,2,2-Trifluoro-1,1-ethanediol
  • 2,2,2-Trifluoroethanediol

Registry Numbers

CAS Registry Number

  • 421-53-4

System Generated Number

  • 0000421534

Structure Descriptors

InChI

1S/C2H3F3O2/c3-2(4,5)1(6)7/h1,6-7H

InChIKey

VGJWVEYTYIBXIA-UHFFFAOYSA-N

Smiles

FC(F)(F)C(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1212, 1970.
mouse LD50 intravenous 660mg/kg (660mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Annales Medicinae Experimentalis et Biologiae Fenniae. Vol. 46, Pg. 242, 1968.
mouse LD50 oral 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 1212, 1970.