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Substance Name: 1,2-Cyclohexanedione
RN: 765-87-7
UNII: 75C1OVW0FJ
InChIKey: OILAIQUEIWYQPH-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H8-O2

Molecular Weight

  • 112.127
 
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Names and Synonyms

Name of Substance

  • 1,2-Cyclohexanedione

Synonyms

  • 1,2-Dioxocyclohexane
  • 4-07-00-01982 (Beilstein Handbook Reference)
  • AI3-25042
  • BRN 0507419
  • CCRIS 6296
  • EINECS 212-155-3
  • NSC 32950
  • UNII-75C1OVW0FJ

Systematic Name

  • 1,2-Cyclohexanedione

Registry Numbers

CAS Registry Number

  • 765-87-7

FDA UNII

  • 75C1OVW0FJ

System Generated Number

  • 0000765877

Structure Descriptors

InChI

1S/C6H8O2/c7-5-3-1-2-4-6(5)8/h1-4H2

InChIKey

OILAIQUEIWYQPH-UHFFFAOYSA-N

Smiles

C1(C(CCCC1)=O)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 40 deg C   EXP
Boiling Point 194 deg C   EXP
log P (octanol-water) -0.470 (none)   EST
Atmospheric OH Rate Constant 1.07E-11 cm3/molecule-sec 25 EST

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