Chemical ID: 4119603

c1cc(c(cc1Br)F)C#N
Chemical ID:
4119603
Name [?]:
4-bromo-2-fluoro-benzonitrile
SMILES [?]:
c1cc(c(cc1Br)F)C#N
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C7H3BrFN
All Atoms:10
Heavy Atoms:10
Chiral Atoms:0
ZAP Information [?]
Total:5.56472
Area:298.28
Solvation:-1.89229
Coulombic:-7.21596
Bond Count [?]
All:10
Single:6
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:200.008
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.7
LogP (Chemaxon):2.79

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