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Substance Name: Diacetylmonoxime
RN: 57-71-6
InChIKey: FSEUPUDHEBLWJY-HWKANZROSA-N

Note

  • Used diagnostically for determining urea in blood; myosin ATPase antagonist.

Molecular Formula

  • C4-H7-N-O2

Molecular Weight

  • 101.104
 

Classification Codes

  • Cholinergic Agents
  • Cholinesterase Reactivators
  • Chromogenic Compounds
  • Coloring Agents
  • Drug / Therapeutic Agent
  • Enzyme Inhibitors
  • Enzyme Reactivators
  • Indicators and Reagents
  • Neurotransmitter Agents
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Names and Synonyms

Name of Substance

  • Diacetylmonoxime

Synonyms

  • 2,3-Butanedione 2-oxime
  • 2,3-Butanedione 3-monoxime
  • 2,3-Butanedione oxime
  • 2,3-Butanedione-2-monoxime
  • 2-Oximino-3-butanone
  • 3-Oximino-2-butanone
  • 3-oxo-2-butanone oxime
  • 4-01-00-03646 (Beilstein Handbook Reference)
  • AI3-23962
  • Biacetyl monooxime
  • Biacetyl monoxime
  • BRN 0605582
  • CCRIS 6215
  • DAM
  • DAM (oxime)
  • Diacetyl monooxime
  • Diacetylmonooxime
  • Diacetylmonoxime
  • EINECS 200-348-5
  • Isonitrosoethyl methyl ketone
  • NSC 116103

Systematic Names

  • 2,3-Butanedione 2-oxime
  • 2,3-Butanedione monoxime
  • 2,3-Butanedione, 2-oxime
  • 2,3-Butanedione, monooxime

Registry Numbers

CAS Registry Number

  • 57-71-6

System Generated Number

  • 0000057716

Structure Descriptors

InChI

InChI=1S/C4H7NO2/c1-3(5-7)4(2)6/h7H,1-2H3/b5-3+

InChIKey

FSEUPUDHEBLWJY-HWKANZROSA-N

Smiles

CC(=O)\C(=N\O)\C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 51mg/kg (51mg/kg)   Journal of Pharmaceutical Sciences. Vol. 53, Pg. 1143, 1964.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 76.8 deg C   EXP
Boiling Point 185.5 deg C   EXP
log P (octanol-water) 1.740 (none)   EST
Atmospheric OH Rate Constant 6.32E-13 cm3/molecule-sec 25 EST

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