Chemical ID: 5090030

CC(=O)CCc1ccccc1Br
Chemical ID:
5090030
Name [?]:
4-(2-bromophenyl)butan-2-one
SMILES [?]:
CC(=O)CCc1ccccc1Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C10H11BrO
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:6.99391
Area:353.004
Solvation:-1.83117
Coulombic:-8.00772
Bond Count [?]
All:12
Single:8
Double:4
Rotors:3
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:227.098
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:2.68
LogP (Chemaxon):3.41

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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