Chemical ID: 6693720

Cc1cccc(n1)C#Cc2ccccc2
Chemical ID:
6693720
Name [?]:
2-methyl-6-(2-phenylethynyl)pyridine
SMILES [?]:
Cc1cccc(n1)C#Cc2ccccc2
InChi [?]:
InChI=1/C14H11N/c1-12-6-5-9-14(15-12)11-10-13-7-3-2-4-8-13/h2-9H,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,4,3,11,15,5,9,8,2,10,6,7/E:(3,4)(7,8)/rA:15nCCCCCCNCCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;t8;s9;s10;d11;s12;d13;d10s14;/rC:;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H11N
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:8.61102
Area:399.614
Solvation:-1.37933
Coulombic:-8.08956
Bond Count [?]
All:16
Single:9
Double:6
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:193.244
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.77
LogP (Chemaxon):3.53

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Descriptor Annotations

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