Chemical ID: 4083087

Cc1ccc(c(c1)[NH3+])C
Chemical ID:
4083087
Name [?]:
(2,5-dimethylphenyl)ammonium
SMILES [?]:
Cc1ccc(c(c1)[NH3+])C
InChi [?]:
InChI=1/C8H11N/c1-6-3-4-7(2)8(9)5-6/h3-5H,9H2,1-2H3/p+1
InChi Info:
AuxInfo=1/1/N:1,9,3,4,7,2,5,6,8/rA:9nCCCCCCCN+C/rB:s1;s2;d3;s4;d5;d2s6;s6;s5;/rC:;;;;;;;;;

Chemical Details

Atom Count
Formula:C8H12N+
All Atoms:9
Heavy Atoms:9
Chiral Atoms:0
ZAP Information [?]
Total:-31.413
Area:277.925
Solvation:-38.3611
Coulombic:42.0653
Bond Count [?]
All:9
Single:6
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:122.188
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:1.87
LogP (Chemaxon):2.2

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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