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Substance Name: Indan, 1-(diethylamino)-3-(p-ethoxyphenyl)-, citrate
RN: 101692-44-8
InChIKey: BGMSIQVBWBKDKM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O.C6-H8-O7

Molecular Weight

  • 501.5725
 
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Names and Synonyms

Synonyms

  • 1-Diethylamino-3-(p-ethoxyphenyl)indan citrate
  • 1-p-Aethoxyphenyl-3-diaethylamino-indan citrat
  • 1-p-Aethoxyphenyl-3-diaethylamino-indan citrat [German]

Systematic Name

  • Indan, 1-(diethylamino)-3-(p-ethoxyphenyl)-, citrate

Registry Numbers

CAS Registry Number

  • 101692-44-8

System Generated Number

  • 0101692448

Molecular Formulas

Molecular Formula

  • C21-H27-N-O.C6-H8-O7

Molecular Formula Fragments

  • C21-H27-N-O
  • C6-H8-O7
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27NO.C6H8O7/c1-4-22(5-2)21-15-20(18-9-7-8-10-19(18)21)16-11-13-17(14-12-16)23-6-3;7-3(8)1-6(13,5(11)12)2-4(9)10/h7-14,20-21H,4-6,15H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)

InChIKey

BGMSIQVBWBKDKM-UHFFFAOYSA-N

Smiles

CCN(CC)C1CC(c2c1cccc2)c3ccc(cc3)OCC.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 137mg/kg (137mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 915, 1961.
mouse LD50 oral 347mg/kg (347mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 915, 1961.
rat LD50 intravenous 97mg/kg (97mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 915, 1961.
rat LD50 oral 860mg/kg (860mg/kg) GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA
Arzneimittel-Forschung. Drug Research. Vol. 11, Pg. 915, 1961.