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

C23H22O2 — CID 11782482

IUPAC4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol
SMILESCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C23H22O2/c1-2-6-22(17-7-4-3-5-8-17)23(18-9-13-20(24)14-10-18)19-11-15-21(25)16-12-19/h3-5,7-16,24-25H,2,6H2,1H3
InChIKeyUTLLHWVRVATSPI-UHFFFAOYSA-N
MW330.43 g/mol
LogP5.86
Rot. Bonds5

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

4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol (PubChem CID 11782482) has the molecular formula C23H22O2 and a molecular weight of 330.43 g/mol. Its IUPAC name is 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol.

Molecular Properties

Compound Name4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol
PubChem CID11782482
Molecular FormulaC23H22O2
Molecular Weight330.43 g/mol
Exact Mass330.16
IUPAC Name4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol
SMILESCCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1
InChIInChI=1S/C23H22O2/c1-2-6-22(17-7-4-3-5-8-17)23(18-9-13-20(24)14-10-18)19-11-15-21(25)16-12-19/h3-5,7-16,24-25H,2,6H2,1H3
InChIKeyUTLLHWVRVATSPI-UHFFFAOYSA-N
XLogP5.86
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.43
LogP ≤ 55.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol?
The IUPAC name of 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol (CID 11782482) is 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol.
What is the SMILES notation for 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol?
The canonical SMILES for 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol is CCCC(=C(c1ccc(O)cc1)c1ccc(O)cc1)c1ccccc1.
What is the InChIKey of 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol?
The InChIKey is UTLLHWVRVATSPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H22O2/c1-2-6-22(17-7-4-3-5-8-17)23(18-9-13-20(24)14-10-18)19-11-15-21(25)16-12-19/h3-5,7-16,24-25H,2,6H2,1H3.
What are the key properties of 4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol?
4-[1-(4-hydroxyphenyl)-2-phenylpent-1-enyl]phenol has a molecular weight of 330.43 g/mol, XLogP of 5.86, 5 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-phenylpent-1-enyl]phenol is sourced from PubChem (CID 11782482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).