1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione
TL;DR: 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione (CAS 52046-71-6) is a chemical compound with molecular formula C15H12O3 and molecular weight 240.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-hydroxyphenyl)-3-phenylpropane-1,3-dione
Also Known As: 1-(4-hydroxyphenyl)-3-phenylpropane-1,3-dione, J2.865.078G, 1-(4-Hydroxyphenyl)-3-phenyl-1,3-propanedione, RefChem:225236
| Molecular Formula | C15H12O3 |
|---|---|
| Molecular Weight | 240.08 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 240.07864 |
| Heavy Atoms | 18 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 52046-71-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CC(=O)C2=CC=C(C=C2)O |
| InChIKey | UKQHHKBUTVQHSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione (CAS 52046-71-6), with molecular formula C15H12O3 and molecular weight 240.08 g/mol. IUPAC: 1-(4-hydroxyphenyl)-3-phenylpropane-1,3-dione.
Chemical Property Profile of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione
Property Insights of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione?
The CAS number of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione is 52046-71-6.
What is the molecular formula of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione?
The molecular formula of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione is C15H12O3.
What is the molecular weight of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione?
The molecular weight of 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione is 240.08 g/mol.
Where can I buy 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione?
You can request a quote for 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Hydroxyphenyl)-3-phenylpropane-1,3-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.