Chemical ID: 5141259

c1ccc(cc1)c2ccc(c(c2)Br)[N+](=O)[O-]
Chemical ID:
5141259
Name [?]:
2-bromo-1-nitro-4-phenyl-benzene
SMILES [?]:
c1ccc(cc1)c2ccc(c(c2)Br)[N+](=O)[O-]
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H8BrNO2
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:3.20771
Area:395.012
Solvation:-6.6676
Coulombic:-13.5245
Bond Count [?]
All:17
Single:10
Double:7
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:278.101
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:4.53
LogP (Chemaxon):4.48

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue