Chemical ID: 4260875

Cc1cccc(c1N)[N+](=O)[O-]
Chemical ID:
4260875
Name [?]:
2-methyl-6-nitro-aniline
SMILES [?]:
Cc1cccc(c1N)[N+](=O)[O-]
InChi [?]:
InChI=1/C7H8N2O2/c1-5-3-2-4-6(7(5)8)9(10)11/h2-4H,8H2,1H3
InChi Info:
AuxInfo=1/0/N:1,4,3,5,2,6,7,8,9,10,11/E:(10,11)/CRV:9.5/rA:11nCCCCCCCNN+OO-/rB:s1;s2;d3;s4;d5;d2s6;s7;s6;d9;s9;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C7H8N2O2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:1.59431
Area:300.212
Solvation:-5.91099
Coulombic:-30.212
Bond Count [?]
All:11
Single:7
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:152.151
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.84
LogP (Chemaxon):2.33

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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