Chemical ID: 3967380

Cc1cccc(c1C)Nc2ccccc2C(=O)O
Chemical ID:
3967380
Name [?]:
2-(2,3-dimethylphenyl)aminobenzoic acid
SMILES [?]:
Cc1cccc(c1C)Nc2ccccc2C(=O)O
InChi [?]:
InChI=1/C15H15NO2/c1-10-6-5-9-13(11(10)2)16-14-8-4-3-7-12(14)15(17)18/h3-9,16H,1-2H3,(H,17,18)
InChi Info:
AuxInfo=1/1/N:1,8,13,12,4,3,14,11,5,2,7,15,6,10,16,9,17,18/E:(17,18)/rA:18nCCCCCCCCNCCCCCCCOO/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;s9;s10;d11;s12;d13;d10s14;s15;d16;s16;/rC:;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H15NO2
All Atoms:18
Heavy Atoms:18
Chiral Atoms:0
ZAP Information [?]
Total:8.28001
Area:414.923
Solvation:-2.09306
Coulombic:-40.0279
Bond Count [?]
All:19
Single:12
Double:7
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:241.285
H-Bond Donors:2
H-Bond Acceptors:3
XLogP:4.16
LogP (Chemaxon):4.4

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Descriptor Annotations

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