Chemical ID: 4662428

c1cc(c(cc1[N+](=O)[O-])F)N
Chemical ID:
4662428
Name [?]:
2-fluoro-4-nitro-aniline
SMILES [?]:
c1cc(c(cc1[N+](=O)[O-])F)N
InChi [?]:
InChI=1/C6H5FN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
InChi Info:
AuxInfo=1/0/N:1,2,5,6,4,3,10,11,7,8,9/E:(10,11)/CRV:9.5/rA:11nCCCCCCN+OO-FN/rB:s1;d2;s3;d4;d1s5;s6;d7;s7;s4;s3;/rC:;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C6H5FN2O2
All Atoms:11
Heavy Atoms:11
Chiral Atoms:0
ZAP Information [?]
Total:0.179083
Area:295.069
Solvation:-7.19765
Coulombic:-30.2765
Bond Count [?]
All:11
Single:7
Double:4
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:156.115
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.14
LogP (Chemaxon):1.36

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Descriptor Annotations

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