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Substance Name: 1,3-Propanediol, 2-(N-ethyl-N-tetradecylamino)-2-methyl-, hydrochloride
RN: 17091-21-3
InChIKey: NZXUEOPXTCIHCQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H43-N-O2.Cl-H

Molecular Weight

  • 366.026
 
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Names and Synonyms

Synonym

  • 2-(N-Ethyl-N-tetradecylamino)-2-methyl-1,3-propanediol hydrochloride

Systematic Name

  • 1,3-Propanediol, 2-(N-ethyl-N-tetradecylamino)-2-methyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 17091-21-3

System Generated Number

  • 0017091213

Molecular Formulas

Molecular Formula

  • C19-H43-N-O2.Cl-H

Molecular Formula Fragments

  • C19-H43-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H43NO2.ClH/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-21(5-2)20(3,18-22)19-23;/h22-23H,4-19H2,1-3H3;1H

InChIKey

NZXUEOPXTCIHCQ-UHFFFAOYSA-N

Smiles

C(C(CO)(C)[N@@](CCCCCCCCCCCCCC)CC)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 48mg/kg (48mg/kg)   Toxicology and Applied Pharmacology. Vol. 12(1), Pg. 115, 1968.
mouse LD50 oral 3350mg/kg (3350mg/kg) GASTROINTESTINAL: CHANGE IN STRUCTURE OR FUNCTION OF ESOPHAGUS Toxicology and Applied Pharmacology. Vol. 12(1), Pg. 115, 1968.
mouse LD50 subcutaneous > 3980mg/kg (3980mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Toxicology and Applied Pharmacology. Vol. 12, Pg. 115, 1968.
rat LD50 intravenous 61mg/kg (61mg/kg)   Toxicology and Applied Pharmacology. Vol. 12(1), Pg. 115, 1968.
rat LD50 oral 1500mg/kg (1500mg/kg) GASTROINTESTINAL: CHANGE IN STRUCTURE OR FUNCTION OF ESOPHAGUS Toxicology and Applied Pharmacology. Vol. 12(1), Pg. 115, 1968.
rat LD50 subcutaneous > 4gm/kg (4000mg/kg) GASTROINTESTINAL: NAUSEA OR VOMITING Toxicology and Applied Pharmacology. Vol. 12, Pg. 115, 1968.