4-(4-prop-2-enylphenoxy)phenol

C15H14O2 — CID 141330239

IUPAC4-(4-prop-2-enylphenoxy)phenol
SMILESC=CCc1ccc(Oc2ccc(O)cc2)cc1
InChIInChI=1S/C15H14O2/c1-2-3-12-4-8-14(9-5-12)17-15-10-6-13(16)7-11-15/h2,4-11,16H,1,3H2
InChIKeyDTGQGKFWEDRNRK-UHFFFAOYSA-N
MW226.27 g/mol
LogP3.91
Rot. Bonds4

About 4-(4-prop-2-enylphenoxy)phenol

4-(4-prop-2-enylphenoxy)phenol (PubChem CID 141330239) has the molecular formula C15H14O2 and a molecular weight of 226.27 g/mol. Its IUPAC name is 4-(4-prop-2-enylphenoxy)phenol.

Molecular Properties

Compound Name4-(4-prop-2-enylphenoxy)phenol
PubChem CID141330239
Molecular FormulaC15H14O2
Molecular Weight226.27 g/mol
Exact Mass226.10
IUPAC Name4-(4-prop-2-enylphenoxy)phenol
SMILESC=CCc1ccc(Oc2ccc(O)cc2)cc1
InChIInChI=1S/C15H14O2/c1-2-3-12-4-8-14(9-5-12)17-15-10-6-13(16)7-11-15/h2,4-11,16H,1,3H2
InChIKeyDTGQGKFWEDRNRK-UHFFFAOYSA-N
XLogP3.91
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 4-(4-prop-2-enylphenoxy)phenol with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-prop-2-enylphenoxy)phenol?
The IUPAC name of 4-(4-prop-2-enylphenoxy)phenol (CID 141330239) is 4-(4-prop-2-enylphenoxy)phenol.
What is the SMILES notation for 4-(4-prop-2-enylphenoxy)phenol?
The canonical SMILES for 4-(4-prop-2-enylphenoxy)phenol is C=CCc1ccc(Oc2ccc(O)cc2)cc1.
What is the InChIKey of 4-(4-prop-2-enylphenoxy)phenol?
The InChIKey is DTGQGKFWEDRNRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O2/c1-2-3-12-4-8-14(9-5-12)17-15-10-6-13(16)7-11-15/h2,4-11,16H,1,3H2.
What are the key properties of 4-(4-prop-2-enylphenoxy)phenol?
4-(4-prop-2-enylphenoxy)phenol has a molecular weight of 226.27 g/mol, XLogP of 3.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-prop-2-enylphenoxy)phenol is sourced from PubChem (CID 141330239), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).