Chemical ID: 6714336

CC[NH+](CC)Cc1cccc[nH+]1
Chemical ID:
6714336
Name [?]:
diethyl-(1H-pyridin-2-ylmethyl)ammonium
SMILES [?]:
CC[NH+](CC)Cc1cccc[nH+]1
InChi [?]:
InChI=1/C10H16N2/c1-3-12(4-2)9-10-7-5-6-8-11-10/h5-8H,3-4,9H2,1-2H3/p+2
InChi Info:
AuxInfo=1/1/N:1,5,2,4,9,10,8,11,6,7,12,3/E:(1,2)(3,4)/rA:12nCCN+CCCCCCCCN+/rB:s1;s2;s3;s4;s3;s6;s7;d8;s9;d10;d7s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C10H18N2+2
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:-94.3022
Area:348.225
Solvation:-103.008
Coulombic:84.5589
Bond Count [?]
All:12
Single:9
Double:3
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:166.263
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:1.46
LogP (Chemaxon):1.46

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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