Calcium 2-(3-phenoxyphenyl)propionate
TL;DR: Calcium 2-(3-phenoxyphenyl)propionate (CAS 34597-40-5) is a chemical compound with molecular formula C30H26CaO6 and molecular weight 522.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
calcium bis(2-(3-phenoxyphenyl)propanoate)
Also Known As: Fenoprofen calcium, Nalfon, Fenprofen calcium, Calcium fenoprofen, Fenoprofen Calcium Salt
| Molecular Formula | C30H26CaO6 |
|---|---|
| Molecular Weight | 522.14 g/mol |
| LogP | 4.28 |
| Topological Polar Surface Area | 98.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 522.13556 |
| Heavy Atoms | 37 |
| Complexity | 265.0 |
Chemical Identifiers
| CAS Number | 34597-40-5 |
|---|---|
| SMILES | CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].CC(C1=CC(=CC=C1)OC2=CC=CC=C2)C(=O)[O-].[Ca+2] |
| InChIKey | VHUXSAWXWSTUOD-UHFFFAOYSA-L |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Calcium 2-(3-phenoxyphenyl)propionate (CAS 34597-40-5), with molecular formula C30H26CaO6 and molecular weight 522.14 g/mol. IUPAC: calcium bis(2-(3-phenoxyphenyl)propanoate).
Chemical Property Profile of Calcium 2-(3-phenoxyphenyl)propionate
Property Insights of Calcium 2-(3-phenoxyphenyl)propionate
The XLogP value of 4.28 indicates that Calcium 2-(3-phenoxyphenyl)propionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Calcium 2-(3-phenoxyphenyl)propionate. Following Lipinski's Rule of Five, Calcium 2-(3-phenoxyphenyl)propionate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Calcium 2-(3-phenoxyphenyl)propionate?
The CAS number of Calcium 2-(3-phenoxyphenyl)propionate is 34597-40-5.
What is the molecular formula of Calcium 2-(3-phenoxyphenyl)propionate?
The molecular formula of Calcium 2-(3-phenoxyphenyl)propionate is C30H26CaO6.
What is the molecular weight of Calcium 2-(3-phenoxyphenyl)propionate?
The molecular weight of Calcium 2-(3-phenoxyphenyl)propionate is 522.14 g/mol.
Where can I buy Calcium 2-(3-phenoxyphenyl)propionate?
You can request a quote for Calcium 2-(3-phenoxyphenyl)propionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Calcium 2-(3-phenoxyphenyl)propionate?
Yes, KEHONG BIO provides custom synthesis services for Calcium 2-(3-phenoxyphenyl)propionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.