2D Structure

2,7-Dihydroxynaphthalene


  • SKU Code: CH142119
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Chemical Name - 2,7-Dihydroxynaphthalene
Mol Weight - 160.172
Smiles - Oc1ccc(ccc(O)c2)c2c1
InChI - DFQICHCWIIJABH-UHFFFAOYSA-N
InChIKey - InChI=1S/C10H8O2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,11-12H
Property Name Property Value
Mol Name2,7-Dihydroxynaphthalene
Molweight160.172
Monoisotopic Mass160.05243
Clogp2.1626
Clogs-2.63
H Acceptors2
H Donors2
Total Surface Area120.56
Relative Psa0.21732
Polar Surface Area40.46
Druglikeness-2.2721
Mutagenicnone
Tumorigenicnone
Reproductive Effectivenone
Irritantnone
Shape Index0.58333
Molecular Complexity0.68786
Fragments1
Non H Atoms12
Non Ch Atoms2
Electronegative Atoms2
Rings Closures2
Small Rings2
Aromatic Rings2
Aromatic Atoms10
Sp3 Atoms2
Symmetric Atoms5
SmilesOc1ccc(ccc(O)c2)c2c1
InChIKeyInChI=1S/C10H8O2/c11-9-3-1-7-2-4-10(12)6-8(7)5-9/h1-6,11-12H
InChIDFQICHCWIIJABH-UHFFFAOYSA-N

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