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Substance Name: 2(3H)-Furanone, dihydro-3-(p-fluorobenzyl)-5-(2-propynyloxymethyl)-
RN: 27850-30-2
InChIKey: ZDZYVGFZODKQCD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H15-F-O3

Molecular Weight

  • 262.279
 
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Names and Synonyms

Synonyms

  • BRN 1589743
  • Dihydro-3-(p-fluorobenzyl)-5-(2-propynyloxymethyl)-2(3H)-furanone
  • gamma-Butyrolactone, 2-(p-fluorobenzyl)-4-(2-propynyloxymethyl)-
  • Propargyloxymethyl-4 p-fluorobenzyl-2 gamma-butyrolactone

Systematic Name

  • 2(3H)-Furanone, dihydro-3-(p-fluorobenzyl)-5-(2-propynyloxymethyl)-

Registry Numbers

CAS Registry Number

  • 27850-30-2

System Generated Number

  • 0027850302

Structure Descriptors

InChI

1S/C15H15FO3/c1-2-7-18-9-12-10-19-15(17)14(12)8-11-3-5-13(16)6-4-11/h1,3-6,12,14H,7-10H2

InChIKey

ZDZYVGFZODKQCD-UHFFFAOYSA-N

Smiles

C([C@@H]1[C@@H](COC1=O)COCC#C)c1ccc(F)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1800mg/kg (1800mg/kg)   Chimica Therapeutica. Vol. 5, Pg. 403, 1970.