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Substance Name: Epiquinidine
RN: 572-59-8
UNII: RN974X9U97
InChIKey: LOUPRKONTZGTKE-AFHBHXEDSA-N

Molecular Formula

  • C20-H24-N2-O2

Molecular Weight

  • 324.4216
 
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Names and Synonyms

Name of Substance

  • Epiquinidine

Synonyms

  • EINECS 209-340-6
  • Epiquinidine
  • UNII-RN974X9U97

Systematic Names

  • (9R)-6'-Methoxycinchonan-9-ol
  • Cinchonan-9-al, 6'-methoxy-, (9R)-

Registry Numbers

CAS Registry Number

  • 572-59-8

FDA UNII

  • RN974X9U97

System Generated Number

  • 0000572598

Structure Descriptors

InChI

1S/C20H24N2O2/c1-3-13-12-22-9-7-14(13)10-19(22)20(23)16-6-8-21-18-5-4-15(24-2)11-17(16)18/h3-6,8,11,13-14,19-20,23H,1,7,9-10,12H2,2H3/t13-,14-,19+,20+/m0/s1

InChIKey

LOUPRKONTZGTKE-AFHBHXEDSA-N

Smiles

COc1ccc2c(c1)c(ccn2)[C@H]([C@H]3C[C@@H]4CC[N@]3C[C@@H]4C=C)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 113 deg C   EXP
log P (octanol-water) 2.920 (none)   EST
Atmospheric OH Rate Constant 2.59E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.