Brasilin
TL;DR: Brasilin (CAS 5439-66-7) is a chemical compound with molecular formula C16H14O5 and molecular weight 286.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7,11b-dihydro-6H-indeno[2,1-c]chromene-3,6a,9,10-tetrol
Also Known As: Brazilin, Brasilin, Superbresiline, Braziletto, Hypernic extract
| Molecular Formula | C16H14O5 |
|---|---|
| Molecular Weight | 286.08 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 90.2 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.08414 |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
Chemical Identifiers
| CAS Number | 5439-66-7 |
|---|---|
| SMILES | C1C2=CC(=C(C=C2C3C1(COC4=C3C=CC(=C4)O)O)O)O |
| InChIKey | UWHUTZOCTZJUKC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Brasilin (CAS 5439-66-7), with molecular formula C16H14O5 and molecular weight 286.08 g/mol. IUPAC: 7,11b-dihydro-6H-indeno[2,1-c]chromene-3,6a,9,10-tetrol.
Chemical Property Profile of Brasilin
Property Insights of Brasilin
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Brasilin. The TPSA of 90.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Brasilin. Following Lipinski's Rule of Five, Brasilin has 4 hydrogen bond donor(s) and 5 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 Brasilin?
The CAS number of Brasilin is 5439-66-7.
What is the molecular formula of Brasilin?
The molecular formula of Brasilin is C16H14O5.
What is the molecular weight of Brasilin?
The molecular weight of Brasilin is 286.08 g/mol.
Where can I buy Brasilin?
You can request a quote for Brasilin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Brasilin?
Yes, KEHONG BIO provides custom synthesis services for Brasilin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.