双氯芬酸
TL;DR: 双氯芬酸 (CAS 15307-86-5) is a chemical compound with molecular formula C14H11Cl2NO2 and molecular weight 295.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双氯芬酸
2-[2-(2,6-dichloroanilino)phenyl]acetic acid
Also Known As: diclofenac, Diclofenac acid, dichlofenac, Diclofenaco, Diclophenac
| Molecular Formula | C14H11Cl2NO2 |
|---|---|
| Molecular Weight | 295.02 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.0167 |
| Heavy Atoms | 19 |
| Complexity | 304.0 |
| Melting Point | 283-285 °C |
| Solubility | 2.37 |
Chemical Identifiers
| CAS Number | 15307-86-5 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl |
| InChIKey | DCOPUUMXTXDBNB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双氯芬酸 (CAS 15307-86-5), with molecular formula C14H11Cl2NO2 and molecular weight 295.02 g/mol. IUPAC: 2-[2-(2,6-dichloroanilino)phenyl]acetic acid.
Chemical Property Profile of 双氯芬酸
Property Insights of 双氯芬酸
The XLogP value of 4.4 indicates that 双氯芬酸钠 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 双氯芬酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 双氯芬酸钠 has 2 hydrogen bond donor(s) and 3 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 双氯芬酸钠?
The CAS number of 双氯芬酸钠 is 15307-86-5.
What is the molecular formula of 双氯芬酸钠?
The molecular formula of 双氯芬酸钠 is C14H11Cl2NO2.
What is the molecular weight of 双氯芬酸钠?
The molecular weight of 双氯芬酸钠 is 295.02 g/mol.
Where can I buy 双氯芬酸钠?
You can request a quote for 双氯芬酸钠 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双氯芬酸钠?
Yes, KEHONG BIO provides custom synthesis services for 双氯芬酸钠 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.