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Substance Name: 1,3-Dioxolane-4-methanol, 2-p-cumenyl-2-methyl-
RN: 59902-27-1
InChIKey: LPYIJRGDHWYCLS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-O3

Molecular Weight

  • 236.309
 
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Names and Synonyms

Synonyms

  • 2-(p-Isopropylphenyl)-2-methyl-1,3-dioxolane-4-methanol
  • 2-p-Cumenyl-2-methyl-1,3-dioxolane-4-methanol

Systematic Name

  • 1,3-Dioxolane-4-methanol, 2-p-cumenyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 59902-27-1

System Generated Number

  • 0059902271

Structure Descriptors

InChI

1S/C14H20O3/c1-10(2)11-4-6-12(7-5-11)14(3)16-9-13(8-15)17-14/h4-7,10,13,15H,8-9H2,1-3H3

InChIKey

LPYIJRGDHWYCLS-UHFFFAOYSA-N

Smiles

c1([C@@]2(O[C@@H](CO)CO2)C)ccc(C(C)C)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 508mg/kg (508mg/kg) PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION

BEHAVIORAL: MUSCLE WEAKNESS
Pharmazie. Vol. 31, Pg. 317, 1976.
mouse LD50 oral > 2gm/kg (2000mg/kg)   Pharmazie. Vol. 31, Pg. 317, 1976.