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Substance Name: m-Dioxane, 5-(1-isopropoxyethyl)-2,5-dimethyl-, (Z)-
RN: 19131-74-9
InChIKey: PNLAHFVUUHRTLK-FGWVZKOKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H22-O3

Molecular Weight

  • 202.292
 
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Names and Synonyms

Synonym

  • cis-5-(1-Isopropoxyethyl)-2,5-dimethyl-1,3-dioxane

Systematic Name

  • m-Dioxane, 5-(1-isopropoxyethyl)-2,5-dimethyl-, (Z)-

Registry Numbers

CAS Registry Number

  • 19131-74-9

System Generated Number

  • 0019131749

Structure Descriptors

InChI

1S/C11H22O3/c1-8(2)14-9(3)11(5)6-12-10(4)13-7-11/h8-10H,6-7H2,1-5H3/t9?,10-,11+

InChIKey

PNLAHFVUUHRTLK-FGWVZKOKSA-N

Smiles

C1[C@]([C@H](OC(C)C)C)(CO[C@@H](O1)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1200mg/kg (1200mg/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.