1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol

C114H108O24 — CID 160808394

About 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol

1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol (PubChem CID 160808394) has the molecular formula C114H108O24 and a molecular weight of 1862.09 g/mol. Its IUPAC name is 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol.

Molecular Properties

• Compound Name: 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol
• PubChem CID: 160808394
• Molecular Formula: C114H108O24
• Molecular Weight: 1862.09 g/mol
• Exact Mass: 1860.72
• IUPAC Name: 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol
• SMILES: Cc1c(C)c(O)c(-c2c(O)ccc3ccc(O)cc23)c(C)c1O.Cc1c(C)c(O)c(-c2cc3ccc(O)cc3cc2O)c(C)c1O.Cc1c(C)c(O)c(-c2ccc(O)c3ccc(O)cc23)c(C)c1O.Cc1c(C)c(O)c(-c2ccc(O)c3cccc(O)c23)c(C)c1O.Cc1c(C)c(O)c(-c2ccc3c(O)cccc3c2O)c(C)c1O.Cc1c(C)c(O)c(-c2ccc3cc(O)ccc3c2O)c(C)c1O
• InChI: InChI=1S/6C19H18O4/c1-9-10(2)18(22)16(11(3)17(9)21)15-6-4-12-8-13(20)5-7-14(12)19(15)23;1-9-10(2)19(23)16(11(3)18(9)22)17-14-8-13(20)6-4-12(14)5-7-15(17)21;1-9-10(2)19(23)17(11(3)18(9)22)15-7-12-4-5-14(20)6-13(12)8-16(15)21;1-9-10(2)19(23)17(11(3)18(9)22)14-6-7-16(21)13-5-4-12(20)8-15(13)14;1-9-10(2)18(22)16(11(3)17(9)21)14-8-7-12-13(19(14)23)5-4-6-15(12)20;1-9-10(2)19(23)16(11(3)18(9)22)13-7-8-14(20)12-5-4-6-15(21)17(12)13/h6*4-8,20-23H,1-3H3
• InChIKey: SDZNPVDCDYSBND-UHFFFAOYSA-N
• XLogP: 25.53
• TPSA: 485.52 Ų
• H-Bond Donors: 24
• H-Bond Acceptors: 24
• Rotatable Bonds: 6
• Heavy Atoms: 138
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1862.09
LogP ≤ 5	25.53
H-Bond Donors ≤ 5	24
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'hydroquinone', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol?

The IUPAC name of 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol (CID 160808394) is 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol.

What is the SMILES notation for 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol?

The canonical SMILES for 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol is Cc1c(C)c(O)c(-c2c(O)ccc3ccc(O)cc23)c(C)c1O.Cc1c(C)c(O)c(-c2cc3ccc(O)cc3cc2O)c(C)c1O.Cc1c(C)c(O)c(-c2ccc(O)c3ccc(O)cc23)c(C)c1O.Cc1c(C)c(O)c(-c2ccc(O)c3cccc(O)c23)c(C)c1O.Cc1c(C)c(O)c(-c2ccc3c(O)cccc3c2O)c(C)c1O.Cc1c(C)c(O)c(-c2ccc3cc(O)ccc3c2O)c(C)c1O.

What is the InChIKey of 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol?

The InChIKey is SDZNPVDCDYSBND-UHFFFAOYSA-N. The full InChI is InChI=1S/6C19H18O4/c1-9-10(2)18(22)16(11(3)17(9)21)15-6-4-12-8-13(20)5-7-14(12)19(15)23;1-9-10(2)19(23)16(11(3)18(9)22)17-14-8-13(20)6-4-12(14)5-7-15(17)21;1-9-10(2)19(23)17(11(3)18(9)22)15-7-12-4-5-14(20)6-13(12)8-16(15)21;1-9-10(2)19(23)17(11(3)18(9)22)14-6-7-16(21)13-5-4-12(20)8-15(13)14;1-9-10(2)18(22)16(11(3)17(9)21)14-8-7-12-13(19(14)23)5-4-6-15(12)20;1-9-10(2)19(23)16(11(3)18(9)22)13-7-8-14(20)12-5-4-6-15(21)17(12)13/h6*4-8,20-23H,1-3H3.

What are the key properties of 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol?

1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol has a molecular weight of 1862.09 g/mol, XLogP of 25.53, 6 rotatable bonds, 24 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 1-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;2-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol;3-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-2,7-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,5-diol;4-(2,5-dihydroxy-3,4,6-trimethylphenyl)naphthalene-1,6-diol is sourced from PubChem (CID 160808394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).