Chemical Properties of 1-Azabicyclo[2.2.2]octan-3-one (CAS 3731-38-2)

1-Azabicyclo[2.2.2]octan-3-one

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InChI
InChI=1S/C7H11NO/c9-7-5-8-3-1-6(7)2-4-8/h6H,1-5H2
InChI Key
ZKMZPXWMMSBLNO-UHFFFAOYSA-N
Formula
C7H11NO
SMILES
O=C1CN2CCC1CC2
Molecular Weight1
125.17
CAS
3731-38-2
Other Names
  • 3-Quinuclidinone
  • 3-Oxoquinuclidine
  • 3-Quinuclidone
  • MKC-2
  • Quinuclidone 3
  • Quinuclidin-3-one
  • NSC 168448
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Physical Properties

Property Value Unit Source
PAff 936.00 kJ/mol NIST
BasG 905.20 kJ/mol NIST
IE 8.20 eV NIST
log10WS -0.15 Crippen Calculated Property
logPoct/wat 0.281 Crippen Calculated Property
McVol 99.320 ml/mol McGowan Calculated Property

Similar Compounds

1-Acetyl-4-piperidinecarboxylic acid. Quinuclidine. Piperidine, 4-methyl-1-propyl. Piperidine, 1-butyl-4-methyl. Cyclopentanecarboxamide, N-butyl-N-3-methylbutyl-. Piperidine, 1-ethyl-4-methyl. 4-Carboxy-1-piperidineacetic acid, 4-ethyl-1, methyl ester. Lycopodine. Cyclopentanecarboxamide, N,N-didecyl-. Cyclopentanecarboxamide, N-heptyl-N-octyl-. Cyclopentanecarboxamide, N,N-dinonyl-. Cyclopentanecarboxamide, N,N-dioctyl-. Cyclopentanecarboxamide, N,N-diundecyl-. Isonipecotic acid, N-(3-methylbutyryl)-, ethyl ester. Cyclopentanecarboxamide, N,N-diheptyl-.

Find more compounds similar to 1-Azabicyclo[2.2.2]octan-3-one.

Sources

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