Chemical ID: 4612558

CC1(C2CCC1(C(C2)OC(=O)C[N+]3(CCOCC3)C)C)C
Chemical ID:
4612558
Name [?]:
(1,7,7-trimethylnorbornan-2-yl) 2-(4-methyl-1-oxa-4-azoniacyclohex-4-yl)acetate
SMILES [?]:
CC1(C2CCC1(C(C2)OC(=O)C[N+]3(CCOCC3)C)C)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H30NO3+
All Atoms:21
Heavy Atoms:21
Chiral Atoms:3
ZAP Information [?]
Total:-18.7573
Area:476.497
Solvation:-30.6697
Coulombic:-0.076365
Bond Count [?]
All:23
Single:22
Double:1
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:296.425
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.33
LogP (Chemaxon):-2.5

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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