Chemical ID: 6681791

Cc1cccc(c1)Nc2ccccc2
Chemical ID:
6681791
Name [?]:
3-methyl-N-phenyl-aniline
SMILES [?]:
Cc1cccc(c1)Nc2ccccc2
InChi [?]:
InChI=1/C13H13N/c1-11-6-5-9-13(10-11)14-12-7-3-2-4-8-12/h2-10,14H,1H3
InChi Info:
AuxInfo=1/0/N:1,12,11,13,4,3,10,14,5,7,2,9,6,8/E:(3,4)(7,8)/rA:14nCCCCCCCNCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;s8;s9;d10;s11;d12;d9s13;/rC:;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C13H13N
All Atoms:14
Heavy Atoms:14
Chiral Atoms:0
ZAP Information [?]
Total:8.01937
Area:361.74
Solvation:-1.02414
Coulombic:-13.8076
Bond Count [?]
All:15
Single:9
Double:6
Rotors:2
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:183.249
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:3.67
LogP (Chemaxon):3.77

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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