4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol

C21H18O2 — CID 11141183

IUPAC4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol
SMILESCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C21H18O2/c1-15(16-5-3-2-4-6-16)21(17-7-11-19(22)12-8-17)18-9-13-20(23)14-10-18/h2-14,22-23H,1H3
InChIKeyVGWVLJXJHQENDY-UHFFFAOYSA-N
MW302.37 g/mol
LogP5.08
Rot. Bonds3

About 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol

4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol (PubChem CID 11141183) has the molecular formula C21H18O2 and a molecular weight of 302.37 g/mol. Its IUPAC name is 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol.

Molecular Properties

Compound Name4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol
PubChem CID11141183
Molecular FormulaC21H18O2
Molecular Weight302.37 g/mol
Exact Mass302.13
IUPAC Name4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol
SMILESCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C21H18O2/c1-15(16-5-3-2-4-6-16)21(17-7-11-19(22)12-8-17)18-9-13-20(23)14-10-18/h2-14,22-23H,1H3
InChIKeyVGWVLJXJHQENDY-UHFFFAOYSA-N
XLogP5.08
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.37
LogP ≤ 55.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-tert-Pentylphenol
CID 6643
P-Cresol
CID 2879
Diethylstilbestrol
CID 448537
Bisphenol A
CID 6623
2,4-Dimethylphenol
CID 7771
Dienestrol
CID 667476
(1,1'-Biphenyl)-2-ol
CID 7017
4-tert-Butylphenol
CID 7393
Tyrosol
CID 10393
Magnolol
CID 72300
Hexestrol
CID 192197
4-Nonylphenol
CID 1752

Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol?
The IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol (CID 11141183) is 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol.
What is the SMILES notation for 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol?
The canonical SMILES for 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol is CC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol?
The InChIKey is VGWVLJXJHQENDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18O2/c1-15(16-5-3-2-4-6-16)21(17-7-11-19(22)12-8-17)18-9-13-20(23)14-10-18/h2-14,22-23H,1H3.
What are the key properties of 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol?
4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol has a molecular weight of 302.37 g/mol, XLogP of 5.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-(4-hydroxyphenyl)-2-phenylprop-1-enyl]phenol is sourced from PubChem (CID 11141183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).