芹菜定
TL;DR: 芹菜定 (CAS 116807-22-8) is a chemical compound with molecular formula C15H11ClO4 and molecular weight 290.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
芹菜定
2-(4-hydroxyphenyl)chromenylium-5,7-diol chloride
Also Known As: Apigeninidin, Apigeninidin chloride, Apigenidin, Gesneridin, Apigeninidin (chloride)
| Molecular Formula | C15H11ClO4 |
|---|---|
| Molecular Weight | 290.03 g/mol |
| LogP | 0.5017 |
| Topological Polar Surface Area | 61.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 290.03458 |
| Heavy Atoms | 20 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 116807-22-8 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=[O+]C3=CC(=CC(=C3C=C2)O)O)O.[Cl-] |
| InChIKey | GYQDOAKHUGURPD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
芹菜定 (CAS 116807-22-8), with molecular formula C15H11ClO4 and molecular weight 290.03 g/mol. IUPAC: 2-(4-hydroxyphenyl)chromenylium-5,7-diol chloride.
Chemical Property Profile of 芹菜定
Property Insights of 芹菜定
The XLogP value of 0.5017 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 芹菜定. The TPSA of 61.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 芹菜定. Following Lipinski's Rule of Five, 芹菜定 has 3 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 芹菜定?
The CAS number of 芹菜定 is 116807-22-8.
What is the molecular formula of 芹菜定?
The molecular formula of 芹菜定 is C15H11ClO4.
What is the molecular weight of 芹菜定?
The molecular weight of 芹菜定 is 290.03 g/mol.
Where can I buy 芹菜定?
You can request a quote for 芹菜定 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 芹菜定?
Yes, KEHONG BIO provides custom synthesis services for 芹菜定 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.