Chemical ID: 6589486

Cc1cc(ccc1N)N=Nc2ccccc2OC
Chemical ID:
6589486
Name [?]:
4-(2-methoxyphenyl)azo-2-methyl-aniline
SMILES [?]:
Cc1cc(ccc1N)N=Nc2ccccc2OC
InChi [?]:
InChI=1/C14H15N3O/c1-10-9-11(7-8-12(10)15)16-17-13-5-3-4-6-14(13)18-2/h3-9H,15H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,18,13,14,12,15,5,6,3,2,4,7,11,16,8,9,10,17/rA:18nCCCCCCCNNNCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;s4;w9;s10;s11;d12;s13;d14;d11s15;s16;s17;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C14H15N3O
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:6.74877
Area:407.053
Solvation:-3.42754
Coulombic:-28.2865
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:241.289
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:3.46
LogP (Chemaxon):3.78

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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