4-[(4-prop-2-enoxyphenyl)methyl]phenol

C16H16O2 — CID 68636078

IUPAC4-[(4-prop-2-enoxyphenyl)methyl]phenol
SMILESC=CCOc1ccc(Cc2ccc(O)cc2)cc1
InChIInChI=1S/C16H16O2/c1-2-11-18-16-9-5-14(6-10-16)12-13-3-7-15(17)8-4-13/h2-10,17H,1,11-12H2
InChIKeyACDVVFFOZNKPNP-UHFFFAOYSA-N
MW240.30 g/mol
LogP3.55
Rot. Bonds5

About 4-[(4-prop-2-enoxyphenyl)methyl]phenol

4-[(4-prop-2-enoxyphenyl)methyl]phenol (PubChem CID 68636078) has the molecular formula C16H16O2 and a molecular weight of 240.30 g/mol. Its IUPAC name is 4-[(4-prop-2-enoxyphenyl)methyl]phenol.

Molecular Properties

Compound Name4-[(4-prop-2-enoxyphenyl)methyl]phenol
PubChem CID68636078
Molecular FormulaC16H16O2
Molecular Weight240.30 g/mol
Exact Mass240.12
IUPAC Name4-[(4-prop-2-enoxyphenyl)methyl]phenol
SMILESC=CCOc1ccc(Cc2ccc(O)cc2)cc1
InChIInChI=1S/C16H16O2/c1-2-11-18-16-9-5-14(6-10-16)12-13-3-7-15(17)8-4-13/h2-10,17H,1,11-12H2
InChIKeyACDVVFFOZNKPNP-UHFFFAOYSA-N
XLogP3.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 53.55
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-enoxyphenyl)methyl]phenol with MolForge

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

Launch Full Analysis

Related Compounds

4-(4-prop-2-enoxyphenyl)phenol
CID 14817245
1-prop-2-enoxy-4-[[4-[3-[4-[(4-prop-2-enoxyphenyl)methyl]phenoxy]propoxy]phenyl]methyl]benzene
CID 59168518
phenol;4-prop-2-enoxyphenol
CID 70303777
4-[1,2,2-tris(4-prop-2-enoxyphenyl)ethyl]phenol
CID 118013728
(4-hydroxyphenyl)methyl 4-prop-2-enoxybenzoate
CID 175436244
4-[2-[(4-prop-2-enoxyphenyl)methylamino]ethyl]phenol
CID 61237649
4-[[4-(sulfanylmethoxy)phenyl]methyl]phenol
CID 89039452
1-(2-prop-2-enoxyethoxy)-4-[[4-(2-prop-2-enoxyethoxy)phenyl]methyl]benzene
CID 22082109
4-[(4-hydroxyphenyl)methyl]phenol
CID 12111
1-prop-2-enoxy-4-[4-(4-prop-2-enylphenyl)phenyl]benzene
CID 67815398
3-(4-prop-2-enoxyphenyl)propan-1-ol
CID 54214209
4-[[4-(4-hydroxyphenyl)phenyl]methyl]phenol
CID 58720488

Frequently Asked Questions

What is the IUPAC name of 4-[(4-prop-2-enoxyphenyl)methyl]phenol?
The IUPAC name of 4-[(4-prop-2-enoxyphenyl)methyl]phenol (CID 68636078) is 4-[(4-prop-2-enoxyphenyl)methyl]phenol.
What is the SMILES notation for 4-[(4-prop-2-enoxyphenyl)methyl]phenol?
The canonical SMILES for 4-[(4-prop-2-enoxyphenyl)methyl]phenol is C=CCOc1ccc(Cc2ccc(O)cc2)cc1.
What is the InChIKey of 4-[(4-prop-2-enoxyphenyl)methyl]phenol?
The InChIKey is ACDVVFFOZNKPNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O2/c1-2-11-18-16-9-5-14(6-10-16)12-13-3-7-15(17)8-4-13/h2-10,17H,1,11-12H2.
What are the key properties of 4-[(4-prop-2-enoxyphenyl)methyl]phenol?
4-[(4-prop-2-enoxyphenyl)methyl]phenol has a molecular weight of 240.30 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(4-prop-2-enoxyphenyl)methyl]phenol is sourced from PubChem (CID 68636078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).