Chemical ID: 5682066

CC(=O)OC1(C[NH+]2CCC1CC2)C#N
Chemical ID:
5682066
Name [?]:
(8-cyano-1-azoniabicyclo[2.2.2]oct-8-yl) acetate
SMILES [?]:
CC(=O)OC1(C[NH+]2CCC1CC2)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H15N2O2+
All Atoms:14
Heavy Atoms:14
Chiral Atoms:1
ZAP Information [?]
Total:-24.2429
Area:347.055
Solvation:-32.9193
Coulombic:11.5894
Bond Count [?]
All:15
Single:13
Double:1
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:195.238
H-Bond Donors:1
H-Bond Acceptors:4
XLogP:-0.09
LogP (Chemaxon):0.02

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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