bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol

C175H142O27S — CID 161300578

IUPACbis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol
SMILESO=C(c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1)c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1.O=S(=O)(c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1)c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1.Oc1ccc(Cc2cc(-c3cc(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c3)cc(Cc3ccc(O)cc3)c2O)cc1.Oc1ccc(Cc2cc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)cc3c(Cc3ccc(O)cc3)c2O)cc1
InChIInChI=1S/C56H42O8S.C41H34O7.C40H34O6.C38H32O6/c57-51-21-17-33-9-1-5-13-43(33)47(51)29-37-25-41(26-38(55(37)61)30-48-44-14-6-2-10-34(44)18-22-52(48)58)65(63,64)42-27-39(31-49-45-15-7-3-11-35(45)19-23-53(49)59)56(62)40(28-42)32-50-46-16-8-4-12-36(46)20-24-54(50)60;42-35-9-1-25(2-10-35)17-29-21-33(22-30(39(29)46)18-26-3-11-36(43)12-4-26)41(48)34-23-31(19-27-5-13-37(44)14-6-27)40(47)32(24-34)20-28-7-15-38(45)16-8-28;41-35-9-1-25(2-10-35)17-31-21-29(22-32(39(31)45)18-26-3-11-36(42)12-4-26)30-23-33(19-27-5-13-37(43)14-6-27)40(46)34(24-30)20-28-7-15-38(44)16-8-28;39-29-9-1-23(2-10-29)17-27-21-33-34(35(37(27)43)19-25-5-13-31(41)14-6-25)22-28(18-24-3-11-30(40)12-4-24)38(44)36(33)20-26-7-15-32(42)16-8-26/h1-28,57-62H,29-32H2;1-16,21-24,42-47H,17-20H2;1-16,21-24,41-46H,17-20H2;1-16,21-22,39-44H,17-20H2
InChIKeyVHODOUPODYJUHH-UHFFFAOYSA-N
MW2709.10 g/mol
LogP34.63
Rot. Bonds37

About bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol

bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol (PubChem CID 161300578) has the molecular formula C175H142O27S and a molecular weight of 2709.10 g/mol. Its IUPAC name is bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol.

Molecular Properties

Compound Namebis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol
PubChem CID161300578
Molecular FormulaC175H142O27S
Molecular Weight2709.10 g/mol
Exact Mass2706.95
IUPAC Namebis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol
SMILESO=C(c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1)c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1.O=S(=O)(c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1)c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1.Oc1ccc(Cc2cc(-c3cc(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c3)cc(Cc3ccc(O)cc3)c2O)cc1.Oc1ccc(Cc2cc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)cc3c(Cc3ccc(O)cc3)c2O)cc1
InChIInChI=1S/C56H42O8S.C41H34O7.C40H34O6.C38H32O6/c57-51-21-17-33-9-1-5-13-43(33)47(51)29-37-25-41(26-38(55(37)61)30-48-44-14-6-2-10-34(44)18-22-52(48)58)65(63,64)42-27-39(31-49-45-15-7-3-11-35(45)19-23-53(49)59)56(62)40(28-42)32-50-46-16-8-4-12-36(46)20-24-54(50)60;42-35-9-1-25(2-10-35)17-29-21-33(22-30(39(29)46)18-26-3-11-36(43)12-4-26)41(48)34-23-31(19-27-5-13-37(44)14-6-27)40(47)32(24-34)20-28-7-15-38(45)16-8-28;41-35-9-1-25(2-10-35)17-31-21-29(22-32(39(31)45)18-26-3-11-36(42)12-4-26)30-23-33(19-27-5-13-37(43)14-6-27)40(46)34(24-30)20-28-7-15-38(44)16-8-28;39-29-9-1-23(2-10-29)17-27-21-33-34(35(37(27)43)19-25-5-13-31(41)14-6-25)22-28(18-24-3-11-30(40)12-4-24)38(44)36(33)20-26-7-15-32(42)16-8-26/h1-28,57-62H,29-32H2;1-16,21-24,42-47H,17-20H2;1-16,21-24,41-46H,17-20H2;1-16,21-22,39-44H,17-20H2
InChIKeyVHODOUPODYJUHH-UHFFFAOYSA-N
XLogP34.63
TPSA536.73 Ų
H-Bond Donors24
H-Bond Acceptors27
Rotatable Bonds37
Heavy Atoms203
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002709.10
LogP ≤ 534.63
H-Bond Donors ≤ 524
H-Bond Acceptors ≤ 1027

Analyze bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol with MolForge

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Related Compounds

[[6-(4-Hydroxybenzoyl)naphthalen-2-yl]-diphenyl-lambda4-sulfanyl] 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
CID 141760357
3-[5-[1,1,1,3,3,3-Hexafluoro-2-[4-hydroxy-3-[7-sulfo-4-(trioxidanylsulfanyl)naphthalene-2-carbonyl]phenyl]propan-2-yl]-2-hydroxybenzoyl]-6-(trioxidanylsulfanyl)naphthalene-1-sulfonic acid;3-[2-hydroxy-5-[4-hydroxy-3-[7-sulfo-4-(trioxidanylsulfanyl)naphthalene-2-carbonyl]benzoyl]benzoyl]-6-(trioxidanylsulfanyl)naphthalene-1-sulfonic acid;3-[5-hydroxy-2-[4-hydroxy-2-[7-sulfo-4-(trioxidanylsulfanyl)naphthalene-2-carbonyl]phenyl]sulfonylbenzoyl]-6-(trioxidanylsulfanyl)naphthalene-1-sulfonic acid
CID 159042131
3-[4-[Dimethyl-(4-methyl-3-oxopent-4-enoyl)-lambda4-sulfanyl]phenoxy]sulfonyl-1,1,2,2,3,3-hexafluoropropane-1-sulfonic acid;1,1,2,2,3,3-hexafluoro-3-[5-[4-(hydroxymethyl)-3-oxopent-4-enoyl]naphthalen-1-yl]oxysulfonylpropane-1-sulfonic acid;1,1,2,2,3,3-hexafluoro-3-[4-(4-methyl-3-oxopent-4-enoyl)phenoxy]sulfonylpropane-1-sulfonic acid
CID 159785767
2-(2,4-Dihydroxy-5-phenacylphenyl)-1-phenylethanone;ethane;2-[5-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxy-3-phenacylphenyl)propan-2-yl]-2-hydroxyphenyl]-1-phenylethanone;2-[2-hydroxy-5-[2-(4-hydroxy-3-phenacylphenyl)propan-2-yl]phenyl]-1-phenylethanone;2-[2-hydroxy-5-(4-hydroxy-3-phenacylphenyl)sulfonylphenyl]-1-phenylethanone;2-(4-hydroxy-3-phenacylphenyl)-1-phenylethanone
CID 160029004
6-hydroxy-3,4-dihydro-2H-naphthalen-1-one;6-(4-hydroxyphenyl)-3,4-dihydro-2H-naphthalen-1-one;6-(4-hydroxyphenyl)naphthalen-1-ol;methane;(5-oxo-7,8-dihydro-6H-naphthalen-2-yl) trifluoromethanesulfonate;trifluoromethylsulfonyl trifluoromethanesulfonate
CID 161094259
Bis[4-hydroxy-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]methanone;4-[1,1,1,3,3,3-hexafluoro-2-(4-hydroxyphenyl)propan-2-yl]-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol;4-[1,1,1,3,3,3-hexafluoro-2-[4-hydroxy-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]propan-2-yl]-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol;(4-hydroxyphenyl)-[4-hydroxy-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]methanone;4-(4-hydroxyphenyl)sulfonyl-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol;4-[2-[4-hydroxy-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]butan-2-yl]-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol;4-[4-hydroxy-3-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenyl]sulfonyl-2-(1,1,1-trifluoro-2-hydroxypropan-2-yl)phenol
CID 161681147
[6-(4-Hydroxybenzoyl)naphthalen-2-yl]-diphenylsulfanium;1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
CID 175782269
7H-Benz(de)anthracene-9-sulfonic acid, 3-hydroxy-7-oxo-, sodium salt
CID 23688074
[4-Benzoyl-2-(2,5-dibenzoyl-4-hydroxyphenyl)sulfonyl-5-hydroxyphenyl]-phenylmethanone
CID 20228372
6-hydroxy-5-(naphthalen-1-ylsulfanylmethyl)-3,4-dihydro-2H-naphthalen-1-one
CID 22324704
6-hydroxy-5-[(phenylsulfonyl)methyl]-3,4-dihydro-1(2H)-naphthalenone
CID 22324758
[6-(4-Hydroxybenzoyl)oxy-10-(4-hydroxyphenyl)sulfonylanthracen-2-yl] 4-hydroxybenzoate
CID 22903171

Frequently Asked Questions

What is the IUPAC name of bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol?
The IUPAC name of bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol (CID 161300578) is bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol.
What is the SMILES notation for bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol?
The canonical SMILES for bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol is O=C(c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1)c1cc(Cc2ccc(O)cc2)c(O)c(Cc2ccc(O)cc2)c1.O=S(=O)(c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1)c1cc(Cc2c(O)ccc3ccccc23)c(O)c(Cc2c(O)ccc3ccccc23)c1.Oc1ccc(Cc2cc(-c3cc(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)c3)cc(Cc3ccc(O)cc3)c2O)cc1.Oc1ccc(Cc2cc3c(Cc4ccc(O)cc4)c(O)c(Cc4ccc(O)cc4)cc3c(Cc3ccc(O)cc3)c2O)cc1.
What is the InChIKey of bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol?
The InChIKey is VHODOUPODYJUHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C56H42O8S.C41H34O7.C40H34O6.C38H32O6/c57-51-21-17-33-9-1-5-13-43(33)47(51)29-37-25-41(26-38(55(37)61)30-48-44-14-6-2-10-34(44)18-22-52(48)58)65(63,64)42-27-39(31-49-45-15-7-3-11-35(45)19-23-53(49)59)56(62)40(28-42)32-50-46-16-8-4-12-36(46)20-24-54(50)60;42-35-9-1-25(2-10-35)17-29-21-33(22-30(39(29)46)18-26-3-11-36(43)12-4-26)41(48)34-23-31(19-27-5-13-37(44)14-6-27)40(47)32(24-34)20-28-7-15-38(45)16-8-28;41-35-9-1-25(2-10-35)17-31-21-29(22-32(39(31)45)18-26-3-11-36(42)12-4-26)30-23-33(19-27-5-13-37(43)14-6-27)40(46)34(24-30)20-28-7-15-38(44)16-8-28;39-29-9-1-23(2-10-29)17-27-21-33-34(35(37(27)43)19-25-5-13-31(41)14-6-25)22-28(18-24-3-11-30(40)12-4-24)38(44)36(33)20-26-7-15-32(42)16-8-26/h1-28,57-62H,29-32H2;1-16,21-24,42-47H,17-20H2;1-16,21-24,41-46H,17-20H2;1-16,21-22,39-44H,17-20H2.
What are the key properties of bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol?
bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol has a molecular weight of 2709.10 g/mol, XLogP of 34.63, 37 rotatable bonds, 24 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for bis[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]methanone;4-[4-hydroxy-3,5-bis[(4-hydroxyphenyl)methyl]phenyl]-2,6-bis[(4-hydroxyphenyl)methyl]phenol;1-[[2-hydroxy-5-[4-hydroxy-3,5-bis[(2-hydroxynaphthalen-1-yl)methyl]phenyl]sulfonyl-3-[(2-hydroxynaphthalen-1-yl)methyl]phenyl]methyl]naphthalen-2-ol;1,3,5,7-tetrakis[(4-hydroxyphenyl)methyl]naphthalene-2,6-diol is sourced from PubChem (CID 161300578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).