Chem 4 Chlororesorcinol | Cheminformatics
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2D Structure

4-Chlororesorcinol


  • SKU Code: CH137917
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Chemical Name - 4-Chlororesorcinol
Mol Weight - 144.557
Smiles - Oc(cc1)cc(O)c1Cl
Property Name Property Value
Mol Name4-Chlororesorcinol
Molweight144.557
Monoisotopic Mass143.997807
Clogp1.5742
Clogs-1.76
H Acceptors2
H Donors2
Total Surface Area101.38
Relative Psa0.25843
Polar Surface Area40.46
Druglikeness-2.05
Mutagenichigh
Tumorigenicnone
Reproductive Effectivehigh
Irritanthigh
Shape Index0.66667
Molecular Complexity0.72259
Fragments1
Non H Atoms9
Non Ch Atoms3
Electronegative Atoms3
Rings Closures1
Small Rings1
Aromatic Rings1
Aromatic Atoms6
Sp3 Atoms2
SmilesOc(cc1)cc(O)c1Cl
InChIKeyInChI=1S/C6H5ClO2/c7-5-2-1-4(8)3-6(5)9/h1-3,8-9H
InChIJQVAPEJNIZULEK-UHFFFAOYSA-N

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