Chemical ID: 6918065

Cc1cccc(c1C)C(C)c2c[nH]cn2
Chemical ID:
6918065
Name [?]:
4-[1-(2,3-dimethylphenyl)ethyl]-1H-imidazole
SMILES [?]:
Cc1cccc(c1C)C(C)c2c[nH]cn2
InChi [?]:
InChI=1/C13H16N2/c1-9-5-4-6-12(10(9)2)11(3)13-7-14-8-15-13/h4-8,11H,1-3H3,(H,14,15)
InChi Info:
AuxInfo=1/1/N:1,8,10,4,3,5,12,14,2,7,9,6,11,13,15/rA:15cCCCCCCCCCCCCNCN/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;s9;d11;s12;s13;s11d14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H16N2
All Atoms:31
Heavy Atoms:15
Chiral Atoms:1
ZAP Information [?]
Total:7.77723
Area:379.475
Solvation:-1.70965
Coulombic:-16.5387
Bond Count [?]
All:16
Single:11
Double:5
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:200.28
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.13
LogP (Chemaxon):3.27

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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