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Substance Name: 1,2-Propanediol, 3-(methylpropoxy)-
RN: 61940-72-5
InChIKey: XGHAAJWWNQHCQI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H16-O3

Molecular Weight

  • 148.2004
 
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Names and Synonyms

Synonyms

  • 1,2-Propanediol, 3-isobutoxy-
  • 3-(Methylpropoxy)-1,2-propanediol
  • 4-01-00-02757 (Beilstein Handbook Reference)
  • BRN 1698565

Systematic Name

  • 1,2-Propanediol, 3-(methylpropoxy)-

Registry Numbers

CAS Registry Number

  • 61940-72-5

System Generated Number

  • 0061940725

Structure Descriptors

InChI

1S/C7H16O3/c1-6(2)4-10-5-7(9)3-8/h6-9H,3-5H2,1-2H3

InChIKey

XGHAAJWWNQHCQI-UHFFFAOYSA-N

Smiles

CC(C)COCC(CO)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 2519mg/kg (2519mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

PERIPHERAL NERVE AND SENSATION: FLACCID PARALYSIS WITHOUT ANESTHESIA (USUALLY NEUROMUSCULAR BLOCKAGE)
Journal of Pharmacology and Experimental Therapeutics. Vol. 93, Pg. 470, 1948.