Chemical ID: 4118830

c1ccc(cc1)COc2cccc(c2)Br
Chemical ID:
4118830
Name [?]:
1-benzyloxy-3-bromo-benzene
SMILES [?]:
c1ccc(cc1)COc2cccc(c2)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C13H11BrO
All Atoms:15
Heavy Atoms:15
Chiral Atoms:0
ZAP Information [?]
Total:7.95136
Area:400.155
Solvation:-2.0525
Coulombic:-10.5283
Bond Count [?]
All:16
Single:10
Double:6
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:263.13
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:4.44
LogP (Chemaxon):4.36

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