Chemical ID: 5180425

C[N+]1(CCC2CCC1C2OC)C
Chemical ID:
5180425
Name [?]:
8-methoxy-4,4-dimethyl-4-azoniabicyclo[3.2.1]octane
SMILES [?]:
C[N+]1(CCC2CCC1C2OC)C
InChi [?]:
InChI=1/C10H20NO/c1-11(2)7-6-8-4-5-9(11)10(8)12-3/h8-10H,4-7H2,1-3H3/q+1
InChi Info:
AuxInfo=1/0/N:1,12,11,6,7,4,3,5,8,9,2,10/E:(1,2)/CRV:11+1/rA:12cCN+CCCCCCCOCC/rB:s1;s2;s3;s4;s5;s6;s2s7;s5s8;s9;s10;s2;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H20NO+
All Atoms:12
Heavy Atoms:12
Chiral Atoms:3
ZAP Information [?]
Total:-18.1534
Area:316.673
Solvation:-26.0702
Coulombic:12.4833
Bond Count [?]
All:13
Single:13
Double:0
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:170.272
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:-0.44
LogP (Chemaxon):-3.8

Name Annotations

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Descriptor Annotations

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