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Substance Name: Pent-2-en-4-one, 5-(1,3-dioxolan-2-yl)-2-methyl-
RN: 56055-61-9
InChIKey: XFMQMJJSHVGNBG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H14-O3

Molecular Weight

  • 170.2066
 
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Names and Synonyms

Synonyms

  • 2-(4-Methyl-pentene-3-one-2-yl)-1,3-dioxolane
  • 5-(1,3-Dioxolan-2-yl)-2-methylpent-2-en-4-one

Systematic Name

  • Pent-2-en-4-one, 5-(1,3-dioxolan-2-yl)-2-methyl-

Registry Numbers

CAS Registry Number

  • 56055-61-9

System Generated Number

  • 0056055619

Structure Descriptors

InChI

1S/C9H14O3/c1-7(2)5-8(10)6-9-11-3-4-12-9/h5,9H,3-4,6H2,1-2H3

InChIKey

XFMQMJJSHVGNBG-UHFFFAOYSA-N

Smiles

CC(=CC(=O)CC1OCCO1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1350mg/kg (1350mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: ANALGESIA
Pharmaceutical Chemistry Journal Vol. 12, Pg. 630, 1978.