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Substance Name: 1,3-Cyclohexanedione, 2-p-methoxyphenacyl-
RN: 39992-64-8
InChIKey: CDGMHSBSEMTFNG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-O4

Molecular Weight

  • 260.2874
 
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Names and Synonyms

Synonyms

  • 1,3-Cyclohexanedione, 2-(2-(4-methoxyphenyl)-2-oxoethyl)-
  • 2-p-Methoxyphenacylcyclohexane-1,3-dione
  • BRN 5054866

Systematic Name

  • 1,3-Cyclohexanedione, 2-p-methoxyphenacyl-

Registry Numbers

CAS Registry Number

  • 39992-64-8

System Generated Number

  • 0039992648

Structure Descriptors

InChI

1S/C15H16O4/c1-19-11-7-5-10(6-8-11)15(18)9-12-13(16)3-2-4-14(12)17/h5-8,12H,2-4,9H2,1H3

InChIKey

CDGMHSBSEMTFNG-UHFFFAOYSA-N

Smiles

COc1ccc(cc1)C(=O)CC2C(=O)CCCC2=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 21mg/kg (21mg/kg)   Pharmaceutical Chemistry Journal Vol. 14, Pg. 794, 1980.