白屈菜酸
TL;DR: 白屈菜酸 (CAS 99-32-1) is a chemical compound with molecular formula C7H4O6 and molecular weight 184.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
白屈菜酸
4-oxopyran-2,6-dicarboxylic acid
Also Known As: Chelidonic acid, Jervaic acid, 4-OXO-4H-PYRAN-2,6-DICARBOXYLIC ACID, Jervasic acid, Jerva acid
| Molecular Formula | C7H4O6 |
|---|---|
| Molecular Weight | 184.00 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 184.0008 |
| Heavy Atoms | 13 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 99-32-1 |
|---|---|
| SMILES | C1=C(OC(=CC1=O)C(=O)O)C(=O)O |
| InChIKey | PBAYDYUZOSNJGU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
白屈菜酸 (CAS 99-32-1), with molecular formula C7H4O6 and molecular weight 184.00 g/mol. IUPAC: 4-oxopyran-2,6-dicarboxylic acid.
Chemical Property Profile of 白屈菜酸
Property Insights of 白屈菜酸
The XLogP value of -0.4 indicates that 白屈菜酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 白屈菜酸. Following Lipinski's Rule of Five, 白屈菜酸 has 2 hydrogen bond donor(s) and 6 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 白屈菜酸?
The CAS number of 白屈菜酸 is 99-32-1.
What is the molecular formula of 白屈菜酸?
The molecular formula of 白屈菜酸 is C7H4O6.
What is the molecular weight of 白屈菜酸?
The molecular weight of 白屈菜酸 is 184.00 g/mol.
Where can I buy 白屈菜酸?
You can request a quote for 白屈菜酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 白屈菜酸?
Yes, KEHONG BIO provides custom synthesis services for 白屈菜酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.