Chem 2 Furoic Acid | Cheminformatics
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2D Structure

2-Furoic Acid


  • SKU Code: CH137820
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Chemical Name - 2-Furoic Acid
Mol Weight - 112.084
Smiles - OC(c1ccco1)=O
Property Name Property Value
Mol Name2-Furoic Acid
Molweight112.084
Monoisotopic Mass112.016045
Clogp0.3334
Clogs-1.311
H Acceptors3
H Donors1
Total Surface Area87.05
Relative Psa0.46238
Polar Surface Area50.44
Druglikeness-1.1431
Mutagenichigh
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.625
Molecular Flexibility0.3453
Molecular Complexity0.7083
Fragments1
Non H Atoms8
Non Ch Atoms3
Electronegative Atoms3
Rotatable Bonds1
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms5
Sp3 Atoms1
Acidic Oxygens1
SmilesOC(c1ccco1)=O
InChIKeyInChI=1S/C5H4O3/c6-5(7)4-2-1-3-8-4/h1-3H,(H,6,7)
InChISMNDYUVBFMFKNZ-UHFFFAOYSA-N

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