Daphnoretin
TL;DR: Daphnoretin (CAS 2034-69-7) is a chemical compound with molecular formula C19H12O7 and molecular weight 352.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-hydroxy-6-methoxy-3-(2-oxochromen-7-yl)oxychromen-2-one
Also Known As: Daphnoretin, Thymelol, Dephnoretin, edgeworthin, Thymerol
| Molecular Formula | C19H12O7 |
|---|---|
| Molecular Weight | 352.06 g/mol |
| LogP | 3.4059 |
| Topological Polar Surface Area | 99.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.0583 |
| Heavy Atoms | 26 |
| Complexity | 1250.4286 |
Chemical Identifiers
| CAS Number | 2034-69-7 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C=C(C(=O)O2)OC3=CC4=C(C=C3)C=CC(=O)O4)O |
Product Overview
Daphnoretin (CAS 2034-69-7), with molecular formula C19H12O7 and molecular weight 352.06 g/mol. IUPAC: 7-hydroxy-6-methoxy-3-(2-oxochromen-7-yl)oxychromen-2-one.
Chemical Property Profile of Daphnoretin
Property Insights of Daphnoretin
The XLogP value of 3.4059 indicates that Daphnoretin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.11 Ų falls within the moderate polarity range, balancing permeability and solubility for Daphnoretin. Following Lipinski's Rule of Five, Daphnoretin has 1 hydrogen bond donor(s) and 7 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 Daphnoretin?
The CAS number of Daphnoretin is 2034-69-7.
What is the molecular formula of Daphnoretin?
The molecular formula of Daphnoretin is C19H12O7.
What is the molecular weight of Daphnoretin?
The molecular weight of Daphnoretin is 352.06 g/mol.
Where can I buy Daphnoretin?
You can request a quote for Daphnoretin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daphnoretin?
Yes, KEHONG BIO provides custom synthesis services for Daphnoretin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.