Chemical ID: 6047487

C1C=CCC2C1C(=O)OC2=O
Chemical ID:
6047487
Name [?]:
3a,4,7,7a-tetrahydroisobenzofuran-1,3-dione
SMILES [?]:
C1C=CCC2C1C(=O)OC2=O
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C8H8O3
All Atoms:11
Heavy Atoms:11
Chiral Atoms:2
ZAP Information [?]
Total:4.7905
Area:292.314
Solvation:-2.51735
Coulombic:-26.4111
Bond Count [?]
All:12
Single:9
Double:3
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:152.147
H-Bond Donors:0
H-Bond Acceptors:3
XLogP:0.43
LogP (Chemaxon):0.73

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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