Chemical ID: 7109699

Cc1ccc(cc1)CNCc2cccc(c2)Cl
Chemical ID:
7109699
Name [?]:
N-[(3-chlorophenyl)methyl]-1-(p-tolyl)methanamine
SMILES [?]:
Cc1ccc(cc1)CNCc2cccc(c2)Cl
InChi [?]:
InChI=1/C15H16ClN/c1-12-5-7-13(8-6-12)10-17-11-14-3-2-4-15(16)9-14/h2-9,17H,10-11H2,1H3
InChi Info:
AuxInfo=1/0/N:1,13,12,14,3,7,4,6,16,8,10,2,5,11,15,17,9/E:(5,6)(7,8)/rA:17nCCCCCCCCNCCCCCCCCl/rB:s1;s2;d3;s4;d5;d2s6;s5;s8;s9;s10;s11;d12;s13;d14;d11s15;s15;/rC:;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H16ClN
All Atoms:33
Heavy Atoms:17
Chiral Atoms:0
ZAP Information [?]
Total:10.0494
Area:459.922
Solvation:-1.44866
Coulombic:-12.2099
Bond Count [?]
All:18
Single:12
Double:6
Rotors:4
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:245.747
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:4.3
LogP (Chemaxon):4.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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