Chem Para Benzoquinone Pacific | Cheminformatics
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2D Structure

Para Benzoquinone


  • SKU Code: CH139054
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Chemical Name - Para Benzoquinone
Mol Weight - 108.096
Smiles - O=C(C=C1)C=CC1=O
Property Name Property Value
Mol NamePara Benzoquinone
Molweight108.096
Monoisotopic Mass108.02113
Clogp0.0844
Clogs-0.998
H Acceptors2
Total Surface Area88.5
Relative Psa0.29469
Polar Surface Area34.14
Druglikeness-3.0497
Mutagenichigh
Tumorigenichigh
Reproductive Effectivenone
Irritantnone
Shape Index0.75
Molecular Flexibility0.30526
Molecular Complexity0.59947
Fragments1
Non H Atoms8
Non Ch Atoms2
Electronegative Atoms2
Rings Closures1
Small Rings1
Symmetric Atoms5
SmilesO=C(C=C1)C=CC1=O
InChIKeyInChI=1S/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4H
InChIAZQWKYJCGOJGHM-UHFFFAOYSA-N

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