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Substance Name: 2,3-Hexanedione
RN: 3848-24-6
UNII: 559ANR3NVS
InChIKey: MWVFCEVNXHTDNF-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C6-H10-O2

Molecular Weight

  • 114.143
 
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Names and Synonyms

Name of Substance

  • 2,3-Hexanedione

Synonyms

  • 2,3-Hexanedione
  • 4-01-00-03687 (Beilstein Handbook Reference)
  • Acetyl butyryl
  • Acetylbutyryl
  • AI3-35989
  • BRN 1699896
  • Butyryl acetyl
  • EINECS 223-350-8
  • FEMA No. 2558
  • Methyl propyl diketone
  • NSC 31665
  • UNII-559ANR3NVS

Systematic Name

  • 2,3-Hexanedione

Superlist Name

  • 2,3-Hexanedione

Registry Numbers

CAS Registry Number

  • 3848-24-6

FDA UNII

  • 559ANR3NVS

System Generated Number

  • 0003848246

Structure Descriptors

InChI

1S/C6H10O2/c1-3-4-6(8)5(2)7/h3-4H2,1-2H3

InChIKey

MWVFCEVNXHTDNF-UHFFFAOYSA-N

Smiles

C(CCC)(C(C)=O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 697, 1979.
rat LD50 oral > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 17, Pg. 697, 1979.