4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol

C16H16O2 — CID 142764028

IUPAC4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol
SMILESCCOc1ccc(/C=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C16H16O2/c1-2-18-16-11-7-14(8-12-16)4-3-13-5-9-15(17)10-6-13/h3-12,17H,2H2,1H3/b4-3+
InChIKeyOXEFHOWWURSMBU-ONEGZZNKSA-N
MW240.30 g/mol
LogP3.96
Rot. Bonds4

About 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol

4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol (PubChem CID 142764028) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol.

Molecular Properties

Compound Name4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol
PubChem CID142764028
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol
SMILESCCOc1ccc(/C=C/c2ccc(O)cc2)cc1
InChIInChI=1S/C16H16O2/c1-2-18-16-11-7-14(8-12-16)4-3-13-5-9-15(17)10-6-13/h3-12,17H,2H2,1H3/b4-3+
InChIKeyOXEFHOWWURSMBU-ONEGZZNKSA-N
XLogP3.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.96
H-Bond Donors ≤ 51
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-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol?
The IUPAC name of 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol (CID 142764028) is 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol.
What is the SMILES notation for 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol?
The canonical SMILES for 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol is CCOc1ccc(/C=C/c2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol?
The InChIKey is OXEFHOWWURSMBU-ONEGZZNKSA-N. The full InChI is InChI=1S/C16H16O2/c1-2-18-16-11-7-14(8-12-16)4-3-13-5-9-15(17)10-6-13/h3-12,17H,2H2,1H3/b4-3+.
What are the key properties of 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol?
4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol has a molecular weight of 240.30 g/mol, XLogP of 3.96, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4-ethoxyphenyl)ethenyl]phenol is sourced from PubChem (CID 142764028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).