Diaspirin
TL;DR: Diaspirin (CAS 578-19-8) is a chemical compound with molecular formula C18H14O8 and molecular weight 358.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-carboxyphenoxy)-4-oxobutanoyl]oxybenzoic acid
Also Known As: Diaspirin, Succinyldisalicylic acid, Salisuccyl, Succinylsalicylic acid, Bis(2-carboxyphenyl) succinate
| Molecular Formula | C18H14O8 |
|---|---|
| Molecular Weight | 358.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 9 |
| Exact Mass | 358.06888 |
| Heavy Atoms | 26 |
| Complexity | 495.0 |
Chemical Identifiers
| CAS Number | 578-19-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)OC(=O)CCC(=O)OC2=CC=CC=C2C(=O)O |
| InChIKey | PREOBXYMXLETCA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diaspirin (CAS 578-19-8), with molecular formula C18H14O8 and molecular weight 358.07 g/mol. IUPAC: 2-[4-(2-carboxyphenoxy)-4-oxobutanoyl]oxybenzoic acid.
Chemical Property Profile of Diaspirin
Property Insights of Diaspirin
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diaspirin. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diaspirin. Following Lipinski's Rule of Five, Diaspirin has 2 hydrogen bond donor(s) and 8 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 Diaspirin?
The CAS number of Diaspirin is 578-19-8.
What is the molecular formula of Diaspirin?
The molecular formula of Diaspirin is C18H14O8.
What is the molecular weight of Diaspirin?
The molecular weight of Diaspirin is 358.07 g/mol.
Where can I buy Diaspirin?
You can request a quote for Diaspirin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diaspirin?
Yes, KEHONG BIO provides custom synthesis services for Diaspirin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.