Chemical ID: 4153325

c1ccc2c(c1)C(=O)N(C2=O)CCOC(=O)c3cccc(c3)Br
Chemical ID:
4153325
Name [?]:
2-(1,3-dioxoisoindolin-2-yl)ethyl 3-bromobenzoate
SMILES [?]:
c1ccc2c(c1)C(=O)N(C2=O)CCOC(=O)c3cccc(c3)Br
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C17H12BrNO4
All Atoms:23
Heavy Atoms:23
Chiral Atoms:0
ZAP Information [?]
Total:9.995
Area:516.163
Solvation:-2.90909
Coulombic:-47.8378
Bond Count [?]
All:25
Single:16
Double:9
Rotors:5
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:374.186
H-Bond Donors:0
H-Bond Acceptors:5
XLogP:3.68
LogP (Chemaxon):2.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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