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Substance Name: Ammonium, (2-(10',11'-dihydro-5'H-azepin-5'-yl)-1-methyl) ethyltrimethyl-, iodide
RN: 63977-41-3
InChIKey: GDDZHRPTHKQOIP-UHFFFAOYSA-M

Molecular Formula

  • C20-H27-N2.I

Molecular Weight

  • 422.347
 
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Names and Synonyms

Synonym

  • (2-(10',11'-Dihydro-5'H-azepin-5'-yl)-1-methyl) ethyltrimethylammonium iodide

Systematic Name

  • Ammonium, (2-(10',11'-dihydro-5'H-azepin-5'-yl)-1-methyl) ethyltrimethyl-, iodide

Registry Numbers

CAS Registry Number

  • 63977-41-3

System Generated Number

  • 0063977413

Molecular Formulas

Molecular Formula

  • C20-H27-N2.I

Molecular Formula Fragments

  • C20-H27-N2
  • COMPONENT
  • I

Structure Descriptors

InChI

1S/C20H27N2.HI/c1-16(22(2,3)4)15-21-19-11-7-5-9-17(19)13-14-18-10-6-8-12-20(18)21;/h5-12,16H,13-15H2,1-4H3;1H/q+1;/p-1

InChIKey

GDDZHRPTHKQOIP-UHFFFAOYSA-M

Smiles

[IH-].[N+]([C@@H](C)CN1c2c(cccc2)CCc2c1cccc2)(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 9mg/kg (9mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 450, 1959.
rabbit LD50 intravenous 8mg/kg (8mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 450, 1959.
rat LD50 intravenous 3mg/kg (3mg/kg)   Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 450, 1959.