3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione
TL;DR: 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione (CAS 708-10-1) is a chemical compound with molecular formula C10H6O3 and molecular weight 174.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-4-phenylcyclobut-3-ene-1,2-dione
Also Known As: 3-hydroxy-4-phenylcyclobut-3-ene-1,2-dione, cyclobutenedione, 3-hydroxy-4-phenyl-, 1-Hydroxy-2-phenylcyclobutene-3,4-dione, 3-Hydroxy-4-phenyl-3-cyclobutene-1,2-dione, 3-Phenyl-4-hydroxy-3-cyclobutene-1,2-dione
| Molecular Formula | C10H6O3 |
|---|---|
| Molecular Weight | 174.03 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0317 |
| Heavy Atoms | 13 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 708-10-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=C(C(=O)C2=O)O |
| InChIKey | YSWWAKJDYMKMGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione (CAS 708-10-1), with molecular formula C10H6O3 and molecular weight 174.03 g/mol. IUPAC: 3-hydroxy-4-phenylcyclobut-3-ene-1,2-dione.
Chemical Property Profile of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione
Property Insights of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-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 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione?
The CAS number of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione is 708-10-1.
What is the molecular formula of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione?
The molecular formula of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione is C10H6O3.
What is the molecular weight of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione?
The molecular weight of 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione is 174.03 g/mol.
Where can I buy 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione?
You can request a quote for 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Hydroxy-4-phenylcyclobut-3-ene-1,2-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.