Chemical Properties of Pseudococaine (CAS 478-73-9)

Pseudococaine

InChI
InChI=1S/C17H21NO4/c1-18-12-8-9-13(18)15(17(20)21-2)14(10-12)22-16(19)11-6-4-3-5-7-11/h3-7,12-15H,8-10H2,1-2H3/t12?,13?,14-,15?/m0/s1
InChI Key
ZPUCINDJVBIVPJ-YFXXHVASSA-N
Formula
C17H21NO4
SMILES
COC(=O)C1C(OC(=O)c2ccccc2)CC2CCC1N2C
Molecular Weight1
303.35
CAS
478-73-9
Other Names
  • [1R-(2-Endo-3-exo)]-3-(benzolyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylic acid methyl ester
  • Delcaine
  • Depsococaine
  • Dextrocaine
  • Isococaine
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Physical Properties

Property Value Unit Source
log10WS -1.95 Relay (1.0) Calculated Property
logPoct/wat 1.868 Crippen Calculated Property
McVol 229.770 ml/mol McGowan Calculated Property
Inp 2180.00 NIST

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Similar Compounds

Allococaine. Cocaine. ETHYLBENZOYLECGONINE. m-Hydroxycocaine. Benzoylecgonine. Benzoylecgonine-TMS. Propionylecgonine methyl ester. Benzoylecgonine, tert-butyldimethylsilyl ester. Cinnamoylcocaine. Benzoylnorecgonine, trimethylsilyl ester. 1-Methyl-4-piperidyl cyclopentylphenylglycolate. 1-Methyl-4-piperidyl cyclohexylphenylglycolate. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. (1'S,3R,4a'S,5a'S,10a'S)-Methyl 1'-methyl-2-oxo-1',4a',5',5a',7',8',10',10a'-octahydrospiro[indoline-3,6'-pyrano[3,4-f]indolizine]-4'-carboxylate. Yohimbine.

Find more compounds similar to Pseudococaine.

Sources

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