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Substance Name: m-Dioxane, 5-ethyl-2-isopropyl-, (E)-
RN: 22645-27-8
InChIKey: LOVWNVWPXIBGIX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H18-O2

Molecular Weight

  • 158.239
 
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Names and Synonyms

Synonym

  • trans-5-Ethyl-2-isopropyl-1,3-dioxane

Systematic Name

  • m-Dioxane, 5-ethyl-2-isopropyl-, (E)-

Registry Numbers

CAS Registry Number

  • 22645-27-8

System Generated Number

  • 0022645278

Structure Descriptors

InChI

1S/C9H18O2/c1-4-8-5-10-9(7(2)3)11-6-8/h7-9H,4-6H2,1-3H3

InChIKey

LOVWNVWPXIBGIX-UHFFFAOYSA-N

Smiles

C1(OC[C@@H](CC)CO1)C(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg) AUTONOMIC NERVOUS SYSTEM: "SMOOTH MUSCLE RELAXANT (MECHANISM UNDEFINED, SPASMOLYTIC)"

BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY)

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Pharmaceutical Chemistry Journal Vol. 2, Pg. 475, 1968.