5,5'-Biphthalide
TL;DR: 5,5'-Biphthalide (CAS 28874-12-6) is a chemical compound with molecular formula C16H10O4 and molecular weight 266.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(1-oxo-3H-2-benzofuran-5-yl)-3H-2-benzofuran-1-one
Also Known As: 5,5'-Biphthalide, 5,5 -Biphthalide, J1.391.252A, [5,5'-Biisobenzofuran]-1,1'(3H,3'H)-dione, 5,5 -Biisobenzofuran-1,1 (3H,3 H)-dione
| Molecular Formula | C16H10O4 |
|---|---|
| Molecular Weight | 266.06 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 266.05792 |
| Heavy Atoms | 20 |
| Complexity | 392.0 |
Chemical Identifiers
| CAS Number | 28874-12-6 |
|---|---|
| SMILES | C1C2=C(C=CC(=C2)C3=CC4=C(C=C3)C(=O)OC4)C(=O)O1 |
| InChIKey | BYOSKDDPKLNJAR-UHFFFAOYSA-N |
Product Overview
5,5'-Biphthalide (CAS 28874-12-6), with molecular formula C16H10O4 and molecular weight 266.06 g/mol. IUPAC: 5-(1-oxo-3H-2-benzofuran-5-yl)-3H-2-benzofuran-1-one.
Chemical Property Profile of 5,5'-Biphthalide
Property Insights of 5,5'-Biphthalide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,5'-Biphthalide. With a topological polar surface area (TPSA) of 52.6 Ų, 5,5'-Biphthalide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,5'-Biphthalide has 0 hydrogen bond donor(s) and 4 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 5,5'-Biphthalide?
The CAS number of 5,5'-Biphthalide is 28874-12-6.
What is the molecular formula of 5,5'-Biphthalide?
The molecular formula of 5,5'-Biphthalide is C16H10O4.
What is the molecular weight of 5,5'-Biphthalide?
The molecular weight of 5,5'-Biphthalide is 266.06 g/mol.
Where can I buy 5,5'-Biphthalide?
You can request a quote for 5,5'-Biphthalide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,5'-Biphthalide?
Yes, KEHONG BIO provides custom synthesis services for 5,5'-Biphthalide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.