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Substance Name: Hexanoic acid, 5-fluoro-, 2-fluoroethyl ester
RN: 63765-78-6
InChIKey: GTOZSKMMLOMDHE-UHFFFAOYSA-N

Molecular Formula

  • C8-H14-F2-O2

Molecular Weight

  • 180.193
 
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Names and Synonyms

Synonym

  • 2-Fluoroethyl 5-fluorohexoate

Systematic Name

  • Hexanoic acid, 5-fluoro-, 2-fluoroethyl ester

Registry Numbers

CAS Registry Number

  • 63765-78-6

System Generated Number

  • 0063765786

Structure Descriptors

InChI

1S/C8H14F2O2/c1-7(10)3-2-4-8(11)12-6-5-9/h7H,2-6H2,1H3

InChIKey

GTOZSKMMLOMDHE-UHFFFAOYSA-N

Smiles

C(CCC[C@@H](C)F)(OCCF)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LC50 inhalation 150ug/m3 (0.15mg/m3)   Nature. Vol. 160, Pg. 179, 1947.
mouse LD50 subcutaneous 2500ug/kg (2.5mg/kg)   Nature. Vol. 160, Pg. 179, 1947.
rabbit LC50 inhalation 20ug/m3 (0.02mg/m3)   Nature. Vol. 160, Pg. 179, 1947.
rabbit LD50 intravenous 100ug/kg (0.1mg/kg)   Nature. Vol. 160, Pg. 179, 1947.
rat LC50 inhalation 200mg/m3 (200mg/m3)   Nature. Vol. 160, Pg. 179, 1947.
rat LD50 intramuscular 1800ug/kg (1.8mg/kg)   Nature. Vol. 160, Pg. 179, 1947.