Chemical Properties of 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, ethyl ester, [1R-(exo,exo)]- (CAS 529-38-4)

8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, ethyl ester, [1R-(exo,exo)]-

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InChI
InChI=1S/C18H23NO4/c1-3-22-18(21)16-14-10-9-13(19(14)2)11-15(16)23-17(20)12-7-5-4-6-8-12/h4-8,13-16H,3,9-11H2,1-2H3
InChI Key
NMPOSNRHZIWLLL-UHFFFAOYSA-N
Formula
C18H23NO4
SMILES
CCOC(=O)C1C(OC(=O)c2ccccc2)CC2CCC1N2C
Molecular Weight1
317.38
CAS
529-38-4
Other Names
  • [1R-(Exo,exo)]-3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylateacid
  • Cocaethylene
  • Ethylbenzoylecgonine
  • Homocaine
  • thylbenzoylecgonine (cocaethylene)
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Physical Properties

Property Value Unit Source
log10WS -3.22 Crippen Calculated Property
logPoct/wat 2.258 Crippen Calculated Property
McVol 243.860 ml/mol McGowan Calculated Property
Inp 2219.00 NIST

Similar Compounds

Pseudococaine. Cocaine. Allococaine. Benzoylecgonine-TMS. m-Hydroxycocaine. Cinnamoylcocaine. Benzoylecgonine. Propionylecgonine methyl ester. Benzoylecgonine, tert-butyldimethylsilyl ester. Benzoylnorecgonine, trimethylsilyl ester. Mandelic acid, «alpha»-cyclopentyl-, 1-methyl-4-piperidyl ester. 1-Methyl-4-piperidyl cyclohexylphenylglycolate. Cyclopentyl-hydroxy-phenyl-acetic acid 1-methyl-pyrrolidin-3-yl ester. Yohimbine. Ibogaine.

Find more compounds similar to 8-Azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(benzoyloxy)-8-methyl-, ethyl ester, [1R-(exo,exo)]-.

Sources

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