4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol

C65H68O8 — CID 89381517

IUPAC4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol
SMILESCCOc1cc(C)c(C(c2ccc(O)cc2)c2cc(C(c3ccc(O)cc3)c3cc(C(c4ccc(O)cc4)c4ccc(C)cc4OCC)c(C)cc3OCC)c(C)cc2OCC)cc1C(C)c1ccc(O)cc1
InChIInChI=1S/C65H68O8/c1-10-70-59-32-39(5)14-31-52(59)63(45-17-25-49(67)26-18-45)54-37-57(61(72-12-3)34-41(54)7)65(47-21-29-51(69)30-22-47)55-38-58(62(73-13-4)35-42(55)8)64(46-19-27-50(68)28-20-46)53-36-56(60(71-11-2)33-40(53)6)43(9)44-15-23-48(66)24-16-44/h14-38,43,63-69H,10-13H2,1-9H3
InChIKeyUTLDKESJSSLLTM-UHFFFAOYSA-N
MW977.25 g/mol
LogP15.03
Rot. Bonds19

About 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol

4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol (PubChem CID 89381517) has the molecular formula C65H68O8 and a molecular weight of 977.25 g/mol. Its IUPAC name is 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol.

Molecular Properties

Compound Name4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol
PubChem CID89381517
Molecular FormulaC65H68O8
Molecular Weight977.25 g/mol
Exact Mass976.49
IUPAC Name4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol
SMILESCCOc1cc(C)c(C(c2ccc(O)cc2)c2cc(C(c3ccc(O)cc3)c3cc(C(c4ccc(O)cc4)c4ccc(C)cc4OCC)c(C)cc3OCC)c(C)cc2OCC)cc1C(C)c1ccc(O)cc1
InChIInChI=1S/C65H68O8/c1-10-70-59-32-39(5)14-31-52(59)63(45-17-25-49(67)26-18-45)54-37-57(61(72-12-3)34-41(54)7)65(47-21-29-51(69)30-22-47)55-38-58(62(73-13-4)35-42(55)8)64(46-19-27-50(68)28-20-46)53-36-56(60(71-11-2)33-40(53)6)43(9)44-15-23-48(66)24-16-44/h14-38,43,63-69H,10-13H2,1-9H3
InChIKeyUTLDKESJSSLLTM-UHFFFAOYSA-N
XLogP15.03
TPSA117.84 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds19
Heavy Atoms73
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500977.25
LogP ≤ 515.03
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

Analyze 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol with MolForge

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Related Compounds

4-[(2,4-dimethylphenyl)-[5-[(2,4-dimethylphenyl)-[5-[1-(2,4-dimethylphenyl)ethyl]-4-ethoxy-2-hydroxyphenyl]methyl]-4-ethoxy-2-hydroxyphenyl]methyl]-2-[(2,4-dimethylphenyl)-(2-ethoxy-4-hydroxyphenyl)methyl]-5-ethoxyphenol
CID 88558111
1-(2-ethoxy-4-methylphenyl)-N-methylethanamine
CID 63639272
4-[1-[1-(2,4-dimethylphenyl)ethylamino]propyl]phenol
CID 60944426
4-[1-(4-methylphenyl)ethyl]phenol
CID 23036862
4-[(5-hydroxy-2-methylphenyl)-(4-hydroxyphenyl)methyl]-5-methylbenzene-1,2-diol
CID 155000449
2-[(2,4-dimethylphenyl)-[2-hydroxy-5-(4-hydroxyphenyl)phenyl]methyl]-4-(4-hydroxyphenyl)phenol;4-[(2,4-dimethylphenyl)-[4-hydroxy-3-(2-hydroxyphenyl)phenyl]methyl]-2-(2-hydroxyphenyl)phenol;2-[(4-ethylphenyl)-[2-hydroxy-5-(4-hydroxyphenyl)phenyl]methyl]-4-(4-hydroxyphenyl)phenol;4-[(4-ethylphenyl)-[4-hydroxy-3-(2-hydroxyphenyl)phenyl]methyl]-2-(2-hydroxyphenyl)phenol
CID 157445165
(1R)-1-(2-ethoxy-5-methylphenyl)ethanol
CID 63364902
3-ethoxy-4-[1-(2-ethoxy-4-hydroxyphenyl)propyl]phenol
CID 70566041
2-[2-[2-[5-methyl-2,4-bis(1-phenylethyl)phenoxy]ethoxy]ethoxy]ethanol
CID 71335154
(1R)-1-(4-methyl-2-propoxyphenyl)ethanol
CID 63650759
(1R)-1-(4-methyl-2-nonoxyphenyl)ethanol
CID 78947128
4-methyl-2-[1-(4-methylphenyl)ethyl]phenol
CID 46930570

Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol?
The IUPAC name of 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol (CID 89381517) is 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol.
What is the SMILES notation for 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol?
The canonical SMILES for 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol is CCOc1cc(C)c(C(c2ccc(O)cc2)c2cc(C(c3ccc(O)cc3)c3cc(C(c4ccc(O)cc4)c4ccc(C)cc4OCC)c(C)cc3OCC)c(C)cc2OCC)cc1C(C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol?
The InChIKey is UTLDKESJSSLLTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H68O8/c1-10-70-59-32-39(5)14-31-52(59)63(45-17-25-49(67)26-18-45)54-37-57(61(72-12-3)34-41(54)7)65(47-21-29-51(69)30-22-47)55-38-58(62(73-13-4)35-42(55)8)64(46-19-27-50(68)28-20-46)53-36-56(60(71-11-2)33-40(53)6)43(9)44-15-23-48(66)24-16-44/h14-38,43,63-69H,10-13H2,1-9H3.
What are the key properties of 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol?
4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol has a molecular weight of 977.25 g/mol, XLogP of 15.03, 19 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-ethoxy-5-[[2-ethoxy-5-[[2-ethoxy-5-[(2-ethoxy-4-methylphenyl)-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]-(4-hydroxyphenyl)methyl]-4-methylphenyl]ethyl]phenol is sourced from PubChem (CID 89381517), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).