Chemical ID: 4441881

CN(C)CCCCOc1ccc(cc1Cl)Br
Chemical ID:
4441881
Name [?]:
4-(4-bromo-2-chloro-phenoxy)-N,N-dimethyl-butan-1-amine
SMILES [?]:
CN(C)CCCCOc1ccc(cc1Cl)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C12H17BrClNO
All Atoms:16
Heavy Atoms:16
Chiral Atoms:0
ZAP Information [?]
Total:9.35945
Area:469.502
Solvation:-2.37809
Coulombic:-13.8417
Bond Count [?]
All:16
Single:13
Double:3
Rotors:6
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:306.626
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.93
LogP (Chemaxon):3.59

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