Chemical ID: 4336573

COc1ccc(cc1)C=CC(=O)c2cccc(c2)Br
Chemical ID:
4336573
Name [?]:
1-(3-bromophenyl)-3-(4-methoxyphenyl)-prop-2-en-1-one
SMILES [?]:
COc1ccc(cc1)C=CC(=O)c2cccc(c2)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C16H13BrO2
All Atoms:19
Heavy Atoms:19
Chiral Atoms:0
ZAP Information [?]
Total:8.16338
Area:457.549
Solvation:-3.27535
Coulombic:-17.7632
Bond Count [?]
All:20
Single:12
Double:8
Rotors:4
Chiral:1
Rigid Segments:5
Chemical Properties
Molecular Weight:317.177
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:4.56
LogP (Chemaxon):4.55

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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