4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol

C21H20O3 — CID 19875161

IUPAC4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(C(C)(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C21H20O3/c1-21(15-3-9-18(22)10-4-15,16-5-11-19(23)12-6-16)17-7-13-20(24-2)14-8-17/h3-14,22-23H,1-2H3
InChIKeyYROADXSDGLNICS-UHFFFAOYSA-N
MW320.39 g/mol
LogP4.46
Rot. Bonds4

About 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol

4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol (PubChem CID 19875161) has the molecular formula C21H20O3 and a molecular weight of 320.39 g/mol. Its IUPAC name is 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol.

Molecular Properties

Compound Name4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
PubChem CID19875161
Molecular FormulaC21H20O3
Molecular Weight320.39 g/mol
Exact Mass320.14
IUPAC Name4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
SMILESCOc1ccc(C(C)(c2ccc(O)cc2)c2ccc(O)cc2)cc1
InChIInChI=1S/C21H20O3/c1-21(15-3-9-18(22)10-4-15,16-5-11-19(23)12-6-16)17-7-13-20(24-2)14-8-17/h3-14,22-23H,1-2H3
InChIKeyYROADXSDGLNICS-UHFFFAOYSA-N
XLogP4.46
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.39
LogP ≤ 54.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol;tungsten
CID 158462536
ethane;4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol
CID 91273565
methane;4-methoxyphenol
CID 159494332
4-[2-(4-methoxyphenyl)butan-2-yl]phenol
CID 57308830
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)propyl]phenol
CID 22051947
[4-[1-[4-(2,2-dimethylpropanoyloxy)phenyl]-1-(4-methoxyphenyl)ethyl]phenyl] 2,2-dimethylpropanoate
CID 142863748
bis(4-methoxyphenol);zirconium(2+);dichloride
CID 172849740
4-[2-[4-[1,1-bis(4-hydroxyphenyl)ethyl]phenyl]propan-2-yl]phenol
CID 634278
4-[2-[4-[[4-[2-(4-methoxyphenyl)propan-2-yl]phenoxy]-dimethylsilyl]oxyphenyl]propan-2-yl]phenol
CID 140743150
1-methoxy-4-[1-[4-[2-(4-methoxyphenyl)propan-2-yl]phenyl]-1-(4-methylphenyl)ethyl]benzene
CID 118446717
2-tert-butyl-6-methoxynaphthalene;6-tert-butylnaphthalen-2-ol
CID 159191921
benzene-1,2-diol;4-methoxyphenol
CID 70292826

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol?
The IUPAC name of 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol (CID 19875161) is 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol.
What is the SMILES notation for 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol?
The canonical SMILES for 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol is COc1ccc(C(C)(c2ccc(O)cc2)c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol?
The InChIKey is YROADXSDGLNICS-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20O3/c1-21(15-3-9-18(22)10-4-15,16-5-11-19(23)12-6-16)17-7-13-20(24-2)14-8-17/h3-14,22-23H,1-2H3.
What are the key properties of 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol?
4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol has a molecular weight of 320.39 g/mol, XLogP of 4.46, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-hydroxyphenyl)-1-(4-methoxyphenyl)ethyl]phenol is sourced from PubChem (CID 19875161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).