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Substance Name: Propionic acid, 3-(N,N-dimethyl)amino-, methyl ester, methylbromide
RN: 14290-81-4
InChIKey: RRHRWCURNKQTLD-UHFFFAOYSA-M

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H13-N-O2.C-H3-Br

Molecular Weight

  • 226.112
 
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Names and Synonyms

Synonyms

  • Ammonium, ((2-methoxycarbonyl)ethyl)trimethyl-, bromide
  • Methyl(beta-trimethylammonium)propionate bromide
  • Reversed carboxyl analogue of acetylcholine

Systematic Name

  • Propionic acid, 3-(N,N-dimethyl)amino-, methyl ester, methylbromide

Registry Numbers

CAS Registry Number

  • 14290-81-4

Related Registry Number

  • 16271-53-7 (Parent)

System Generated Number

  • 0014290814

Molecular Formulas

Molecular Formula

  • C6-H13-N-O2.C-H3-Br

Molecular Formula Fragments

  • C-H3-Br
  • C6-H13-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C7H16NO2.BrH/c1-8(2,3)6-5-7(9)10-4;/h5-6H2,1-4H3;1H/q+1;/p-1

InChIKey

RRHRWCURNKQTLD-UHFFFAOYSA-M

Smiles

C(CC[N+](C)(C)C)(=O)OC.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 6700ug/kg (6.7mg/kg) BEHAVIORAL: TREMOR

SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 100, Pg. 465, 1950.
mouse LD50 oral 87mg/kg (87mg/kg) BEHAVIORAL: TREMOR

SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS
Journal of Pharmacology and Experimental Therapeutics. Vol. 100, Pg. 465, 1950.