Chemical ID: 6497727

Cc1ccc(cc1)c2ccc[nH]2
Chemical ID:
6497727
Name [?]:
2-(p-tolyl)-1H-pyrrole
SMILES [?]:
Cc1ccc(cc1)c2ccc[nH]2
InChi [?]:
InChI=1/C11H11N/c1-9-4-6-10(7-5-9)11-3-2-8-12-11/h2-8,12H,1H3
InChi Info:
AuxInfo=1/0/N:1,10,9,3,7,4,6,11,2,5,8,12/E:(4,5)(6,7)/rA:12nCCCCCCCCCCCN/rB:s1;s2;d3;s4;d5;d2s6;s5;d8;s9;d10;s8s11;/rC:;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C11H11N
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:7.08975
Area:327.653
Solvation:-1.10158
Coulombic:-12.5842
Bond Count [?]
All:13
Single:8
Double:5
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:157.212
H-Bond Donors:0
H-Bond Acceptors:0
XLogP:3.21
LogP (Chemaxon):2.97

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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