Chemical ID: 5253136

c1cc2c(c(c1)Br)C(=O)OC2=O
Chemical ID:
5253136
Name [?]:
4-bromoisobenzofuran-1,3-dione
SMILES [?]:
c1cc2c(c(c1)Br)C(=O)OC2=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H3BrO3
All Atoms:12
Heavy Atoms:12
Chiral Atoms:0
ZAP Information [?]
Total:5.58106
Area:314.799
Solvation:-2.28891
Coulombic:-28.4667
Bond Count [?]
All:13
Single:8
Double:5
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:227.012
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:2.32
LogP (Chemaxon):1.82

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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