Chem Benzene 2 Molychem | Cheminformatics
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2D Structure

Benzene


  • SKU Code: CH140841
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Chemical Name - Benzene
Mol Weight - 78.1136
Smiles - c1ccccc1
Property Name Property Value
Mol NameBenzene
Molweight78.1136
Monoisotopic Mass78.04695
Clogp1.6596
Clogs-1.616
Total Surface Area73.26
Druglikeness-2.3575
Mutagenichigh
Tumorigenichigh
Reproductive Effectivehigh
Irritanthigh
Shape Index0.66667
Molecular Complexity0.4621
Fragments1
Non H Atoms6
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Symmetric Atoms5
Smilesc1ccccc1
InChIKeyInChI=1S/C6H6/c1-2-4-6-5-3-1/h1-6H
InChIUHOVQNZJYSORNB-UHFFFAOYSA-N

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