Chemical ID: 6424837

c1ccc(cc1)S(=O)(=O)C2CC(=O)OC2c3ccoc3
Chemical ID:
6424837
Name [?]:
5-(3-furyl)-4-phenylsulfonyl-tetrahydrofuran-2-one
SMILES [?]:
c1ccc(cc1)S(=O)(=O)C2CC(=O)OC2c3ccoc3
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H12O5S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:4.99488
Area:432.475
Solvation:-5.817
Coulombic:-25.5781
Bond Count [?]
All:22
Single:14
Double:8
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:292.308
H-Bond Donors:0
H-Bond Acceptors:4
XLogP:1.42
LogP (Chemaxon):1.75

Name Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

ChemicalMix SourceExternal IDDescriptorValue

Experimental Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue

Descriptor Annotations

Note: All annotations are abbreviated. For more detailed information please download chemical.

Chemical MixSourceExternal IDDescriptorValue