![2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate structure](/static/products/1705/170516-08-2.webp)
2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate
TL;DR: 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate (CAS 170516-08-2) is a chemical compound with molecular formula C20H28Cl2N2O5 and molecular weight 446.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2,6-dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate
Also Known As: Diclofenac mixture with epolamine dihydrate, Benzeneacetic acid, 2-((2,6-dichlorophenyl)amino)-, compd. with 1-pyrrolidineethanol (1:1), dihydrate, [2-(2,6-Dichloroanilino)phenyl]acetic acid--2-(pyrrolidin-1-yl)ethan-1-ol--water (1/1/2), 2-[2-(2,6-dichloroanilino)phenyl]acetic acid; 2-pyrrolidin-1-ylethanol; dihydrate, 2-[2-(2,6-dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate
| Molecular Formula | C20H28Cl2N2O5 |
|---|---|
| Molecular Weight | 446.14 g/mol |
| LogP | 2.7892 |
| Topological Polar Surface Area | 74.8 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 446.1375 |
| Heavy Atoms | 29 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 170516-08-2 |
|---|---|
| SMILES | C1CCN(C1)CCO.C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=CC=C2Cl)Cl.O.O |
| InChIKey | DXMHQAMZXJRYJW-UHFFFAOYSA-N |
Product Overview
2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate (CAS 170516-08-2), with molecular formula C20H28Cl2N2O5 and molecular weight 446.14 g/mol. IUPAC: 2-[2-(2,6-dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate.
Chemical Property Profile of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate
Property Insights of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate
The XLogP value of 2.7892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate. The TPSA of 74.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate. Following Lipinski's Rule of Five, 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate has 5 hydrogen bond donor(s) and 7 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 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate?
The CAS number of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate is 170516-08-2.
What is the molecular formula of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate?
The molecular formula of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate is C20H28Cl2N2O5.
What is the molecular weight of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate?
The molecular weight of 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate is 446.14 g/mol.
Where can I buy 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate?
You can request a quote for 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate?
Yes, KEHONG BIO provides custom synthesis services for 2-[2-(2,6-Dichloroanilino)phenyl]acetic acid;2-pyrrolidin-1-ylethanol;dihydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.