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Substance Name: Flopropione [INN:DCF:JAN]
RN: 2295-58-1
UNII: 05V5NVB5Y1
InChIKey: PTHLEKANMPKYDB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H10-O4

Molecular Weight

  • 182.174
 
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Names and Synonyms

Name of Substance

  • Flopropione
  • Flopropione [INN:DCF:JAN]

Synonyms

  • 1-Propanone, 1-(2,4,6-trihydroxyphenyl)-
  • 13907 R. P.
  • 13907 R.P.
  • 2,4,6-Trihydroxypropiophenone
  • 3-08-00-03413 (Beilstein Handbook Reference)
  • AI3-36955
  • Argobyl
  • BRN 2096799
  • Chlonarin
  • Cospanon
  • Ecapron
  • EINECS 218-942-8
  • Flopropion
  • Flopropiona
  • Flopropiona [INN-Spanish]
  • Flopropione
  • Flopropionum
  • Flopropionum [INN-Latin]
  • Gasstenon
  • Labroda
  • Labrodax
  • Labrodax supanate
  • NSC 97909
  • Phloropropionone
  • Phloropropiophenone
  • Propionylphloroglucinol
  • Propiophloroglucine
  • RP 13907
  • Supanate
  • Supazlun
  • UNII-05V5NVB5Y1

Systematic Names

  • 1-(2,4,6-Trihydroxyphenyl)-1-propanone
  • 1-Propanone, 1-(2,4,6-trihydroxyphenyl)-
  • 2',4',6'-Trihydroxypropiophenone
  • Flopropione
  • Propiophenone, 2',4',6'-trihydroxy-

Registry Numbers

CAS Registry Number

  • 2295-58-1

FDA UNII

  • 05V5NVB5Y1

System Generated Number

  • 0002295581

Structure Descriptors

InChI

1S/C9H10O4/c1-2-6(11)9-7(12)3-5(10)4-8(9)13/h3-4,10,12-13H,2H2,1H3

InChIKey

PTHLEKANMPKYDB-UHFFFAOYSA-N

Smiles

c1(c(cc(O)cc1O)O)C(CC)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LD oral > 3gm/kg (3000mg/kg)   Gekkan Yakuji. Pharmaceuticals Monthly. Vol. 10, Pg. 117, 1968.
mouse LD50 intraperitoneal 578mg/kg (578mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
mouse LD50 intravenous 300mg/kg (300mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
mouse LD50 oral 2780mg/kg (2780mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
mouse LD50 subcutaneous 804mg/kg (804mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
rat LD50 intraperitoneal 412mg/kg (412mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
rat LD50 intravenous 246mg/kg (246mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
rat LD50 oral 2380mg/kg (2380mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.
rat LD50 subcutaneous 640mg/kg (640mg/kg)   Drugs in Japan Vol. 6, Pg. 734, 1982.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 175.5 deg C   EXP
log P (octanol-water) 2.280 (none)   EST
Atmospheric OH Rate Constant 2.02E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.