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Substance Name: 3-alpha-Tropanol, 3,3-diphenylpropionate
RN: 20811-86-3
InChIKey: LKUIWRRZERHFOB-UHFFFAOYSA-N

Molecular Formula

  • C23-H27-N-O2

Molecular Weight

  • 349.471
 
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Names and Synonyms

Synonyms

  • 3,3-Diphenylpropionic acid 3-alpha-tropanyl ester
  • Propionic acid, 3,3-diphenyl-, 3-alpha-tropanyl ester

Systematic Name

  • 3-alpha-Tropanol, 3,3-diphenylpropionate

Registry Numbers

CAS Registry Number

  • 20811-86-3

System Generated Number

  • 0020811863

Structure Descriptors

InChI

1S/C23H27NO2/c1-24-20-10-11-21(24)14-19(13-20)17-8-5-9-18(12-17)22(15-23(25)26)16-6-3-2-4-7-16/h2-9,12,19-22H,10-11,13-15H2,1H3,(H,25,26)

InChIKey

LKUIWRRZERHFOB-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)C1C[C@@H]2CC[C@@H](C1)N2C)[C@@H](CC(=O)O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 24mg/kg (24mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 24, 1969.