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Substance Name: Oxazidione [INN:DCF]
RN: 27591-42-0
UNII: OPC1BN901Y
InChIKey: YYRYCTNXXHOENE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H19-N-O3

Molecular Weight

  • 321.3741
 
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Names and Synonyms

Name of Substance

  • Amplidione
  • Oxazidione [INN:DCF]

Synonyms

  • 2-(Morpholinomethyl)-2-phenyl-1,3-indandione
  • 2-Phenyl-2-morpholinomethylindane-1,3-dione
  • Amplidione
  • BRN 1021293
  • EINECS 248-550-2
  • LD 4610
  • Mofedione
  • Oxazidione
  • Oxazidionum
  • Oxazidionum [INN-Latin]
  • Oxaziziona
  • Oxaziziona [INN-Spanish]
  • Transidione
  • UNII-OPC1BN901Y

Systematic Names

  • 1,3-Indandione, 2-(morpholinomethyl)-2-phenyl-
  • 2-(Morpholinomethyl)-2-phenyl-1,3-indanedione
  • Oxazidione
  • Phenyl-2-morpholinomethyl-2-indanedione

Registry Numbers

CAS Registry Number

  • 27591-42-0

FDA UNII

  • OPC1BN901Y

System Generated Number

  • 0027591420

Structure Descriptors

InChI

1S/C20H19NO3/c22-18-16-8-4-5-9-17(16)19(23)20(18,15-6-2-1-3-7-15)14-21-10-12-24-13-11-21/h1-9H,10-14H2

InChIKey

YYRYCTNXXHOENE-UHFFFAOYSA-N

Smiles

O=C1c2ccccc2C(=O)C1(CN3CCOCC3)c4ccccc4

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 235mg/kg (235mg/kg)   "Merck Index; an Encyclopedia of Chemicals, Drugs, and Biologicals", 11th ed., Rahway, NJ 07065, Merck & Co., Inc. 1989Vol. 11, Pg. 1096, 1989.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 88 deg C   EXP
log P (octanol-water) 2.090 (none)   EST
Atmospheric OH Rate Constant 1.80E-10 cm3/molecule-sec 25 EST

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