2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol

C155H130O28 — CID 158639429

IUPAC2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol
SMILESOc1ccc(Cc2c(O)c(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)ccc(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1.Oc1ccc(Cc2ccc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2ccc3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1
InChIInChI=1S/C38H32O7.2C31H26O6.C31H26O5.C24H20O4/c39-28-9-1-22(2-10-28)17-26-21-27(18-23-3-11-29(40)12-4-23)36(43)35-34(26)32(19-24-5-13-30(41)14-6-24)37(44)33(38(35)45)20-25-7-15-31(42)16-8-25;32-22-8-1-18(2-9-22)15-21-7-14-27(35)29-28(21)25(16-19-3-10-23(33)11-4-19)30(36)26(31(29)37)17-20-5-12-24(34)13-6-20;32-22-8-1-18(2-9-22)15-21-7-14-25-26(16-19-3-10-23(33)11-4-19)30(36)27(31(37)28(25)29(21)35)17-20-5-12-24(34)13-6-20;32-25-8-1-19(2-9-25)15-22-7-14-28-29(31(22)36)23(16-20-3-10-26(33)11-4-20)18-24(30(28)35)17-21-5-12-27(34)13-6-21;25-19-7-1-15(2-8-19)13-17-5-11-22-21(23(17)27)12-6-18(24(22)28)14-16-3-9-20(26)10-4-16/h1-16,21,39-45H,17-20H2;2*1-14,32-37H,15-17H2;1-14,18,32-36H,15-17H2;1-12,25-28H,13-14H2
InChIKeyIAEMCXRXZNWWBP-UHFFFAOYSA-N
MW2440.72 g/mol
LogP29.82
Rot. Bonds30

About 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol

2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol (PubChem CID 158639429) has the molecular formula C155H130O28 and a molecular weight of 2440.72 g/mol. Its IUPAC name is 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol.

Molecular Properties

Compound Name2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol
PubChem CID158639429
Molecular FormulaC155H130O28
Molecular Weight2440.72 g/mol
Exact Mass2438.87
IUPAC Name2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol
SMILESOc1ccc(Cc2c(O)c(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)ccc(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1.Oc1ccc(Cc2ccc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2ccc3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1
InChIInChI=1S/C38H32O7.2C31H26O6.C31H26O5.C24H20O4/c39-28-9-1-22(2-10-28)17-26-21-27(18-23-3-11-29(40)12-4-23)36(43)35-34(26)32(19-24-5-13-30(41)14-6-24)37(44)33(38(35)45)20-25-7-15-31(42)16-8-25;32-22-8-1-18(2-9-22)15-21-7-14-27(35)29-28(21)25(16-19-3-10-23(33)11-4-19)30(36)26(31(29)37)17-20-5-12-24(34)13-6-20;32-22-8-1-18(2-9-22)15-21-7-14-25-26(16-19-3-10-23(33)11-4-19)30(36)27(31(37)28(25)29(21)35)17-20-5-12-24(34)13-6-20;32-25-8-1-19(2-9-25)15-22-7-14-28-29(31(22)36)23(16-20-3-10-26(33)11-4-20)18-24(30(28)35)17-21-5-12-27(34)13-6-21;25-19-7-1-15(2-8-19)13-17-5-11-22-21(23(17)27)12-6-18(24(22)28)14-16-3-9-20(26)10-4-16/h1-16,21,39-45H,17-20H2;2*1-14,32-37H,15-17H2;1-14,18,32-36H,15-17H2;1-12,25-28H,13-14H2
InChIKeyIAEMCXRXZNWWBP-UHFFFAOYSA-N
XLogP29.82
TPSA566.44 Ų
H-Bond Donors28
H-Bond Acceptors28
Rotatable Bonds30
Heavy Atoms183
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002440.72
LogP ≤ 529.82
H-Bond Donors ≤ 528
H-Bond Acceptors ≤ 1028

Analyze 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol?
The IUPAC name of 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol (CID 158639429) is 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol.
What is the SMILES notation for 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol?
The canonical SMILES for 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol is Oc1ccc(Cc2c(O)c(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)ccc(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2cc(Cc3ccc(O)cc3)c3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1.Oc1ccc(Cc2ccc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c(O)c3c2O)cc1.Oc1ccc(Cc2ccc3c(O)c(Cc4ccc(O)cc4)ccc3c2O)cc1.
What is the InChIKey of 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol?
The InChIKey is IAEMCXRXZNWWBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C38H32O7.2C31H26O6.C31H26O5.C24H20O4/c39-28-9-1-22(2-10-28)17-26-21-27(18-23-3-11-29(40)12-4-23)36(43)35-34(26)32(19-24-5-13-30(41)14-6-24)37(44)33(38(35)45)20-25-7-15-31(42)16-8-25;32-22-8-1-18(2-9-22)15-21-7-14-27(35)29-28(21)25(16-19-3-10-23(33)11-4-19)30(36)26(31(29)37)17-20-5-12-24(34)13-6-20;32-22-8-1-18(2-9-22)15-21-7-14-25-26(16-19-3-10-23(33)11-4-19)30(36)27(31(37)28(25)29(21)35)17-20-5-12-24(34)13-6-20;32-25-8-1-19(2-9-25)15-22-7-14-28-29(31(22)36)23(16-20-3-10-26(33)11-4-20)18-24(30(28)35)17-21-5-12-27(34)13-6-21;25-19-7-1-15(2-8-19)13-17-5-11-22-21(23(17)27)12-6-18(24(22)28)14-16-3-9-20(26)10-4-16/h1-16,21,39-45H,17-20H2;2*1-14,32-37H,15-17H2;1-14,18,32-36H,15-17H2;1-12,25-28H,13-14H2.
What are the key properties of 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol?
2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol has a molecular weight of 2440.72 g/mol, XLogP of 29.82, 30 rotatable bonds, 28 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,6-tris[(4-hydroxyphenyl)methyl]naphthalene-1,5-diol;2,4,5-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol;2,4,7-tris[(4-hydroxyphenyl)methyl]naphthalene-1,3,8-triol is sourced from PubChem (CID 158639429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).