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Substance Name: 1,2-Propanediol, 3-(o-allylphenoxy)-
RN: 63905-22-6
InChIKey: NRIXNDFJJSOBCR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-O3

Molecular Weight

  • 208.255
 
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Names and Synonyms

Synonyms

  • 3-(o-Allylphenoxy)-1,2-propanediol
  • EINECS 264-554-7

Systematic Names

  • 1,2-Propanediol, 3-(o-allylphenoxy)-
  • 3-(2-Allylphenoxy)propane-1,2-diol

Registry Numbers

CAS Registry Number

  • 63905-22-6

System Generated Number

  • 0063905226

Structure Descriptors

InChI

1S/C12H16O3/c1-2-5-10-6-3-4-7-12(10)15-9-11(14)8-13/h2-4,6-7,11,13-14H,1,5,8-9H2

InChIKey

NRIXNDFJJSOBCR-UHFFFAOYSA-N

Smiles

C([C@@H](COc1c(cccc1)CC=C)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 749mg/kg (749mg/kg) PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: MUSCLE WEAKNESS
Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 470, 1948.