4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol

C24H22O2 — CID 69420956

IUPAC4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol
SMILESC=CC(c1ccc(O)cc1)c1ccccc1C(C=C)c1ccc(O)cc1
InChIInChI=1S/C24H22O2/c1-3-21(17-9-13-19(25)14-10-17)23-7-5-6-8-24(23)22(4-2)18-11-15-20(26)16-12-18/h3-16,21-22,25-26H,1-2H2
InChIKeyKXYDPDBFTITFRV-UHFFFAOYSA-N
MW342.44 g/mol
LogP5.73
Rot. Bonds6

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

4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol (PubChem CID 69420956) has the molecular formula C24H22O2 and a molecular weight of 342.44 g/mol. Its IUPAC name is 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol.

Molecular Properties

Compound Name4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol
PubChem CID69420956
Molecular FormulaC24H22O2
Molecular Weight342.44 g/mol
Exact Mass342.16
IUPAC Name4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol
SMILESC=CC(c1ccc(O)cc1)c1ccccc1C(C=C)c1ccc(O)cc1
InChIInChI=1S/C24H22O2/c1-3-21(17-9-13-19(25)14-10-17)23-7-5-6-8-24(23)22(4-2)18-11-15-20(26)16-12-18/h3-16,21-22,25-26H,1-2H2
InChIKeyKXYDPDBFTITFRV-UHFFFAOYSA-N
XLogP5.73
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500342.44
LogP ≤ 55.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol?
The IUPAC name of 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol (CID 69420956) is 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol.
What is the SMILES notation for 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol?
The canonical SMILES for 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol is C=CC(c1ccc(O)cc1)c1ccccc1C(C=C)c1ccc(O)cc1.
What is the InChIKey of 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol?
The InChIKey is KXYDPDBFTITFRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H22O2/c1-3-21(17-9-13-19(25)14-10-17)23-7-5-6-8-24(23)22(4-2)18-11-15-20(26)16-12-18/h3-16,21-22,25-26H,1-2H2.
What are the key properties of 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol?
4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol has a molecular weight of 342.44 g/mol, XLogP of 5.73, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[2-[1-(4-hydroxyphenyl)prop-2-enyl]phenyl]prop-2-enyl]phenol is sourced from PubChem (CID 69420956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).