RefChem:319194
TL;DR: RefChem:319194 (CAS 42223-04-1) is a chemical compound with molecular formula C21H21Cl2NO4 and molecular weight 421.08478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(4-chloro-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazanium chloride
Also Known As: (4-Chloro-1,3-dioxo-2-phenylindan-2-yl(methoxycarbonyl)methyl)trimethylammonium chloride, 2-Trimethylammoniumacetoxymethyl-2-phenyl-4-chloroindan-1,3-dionechloride, Ammonium, carboxymethyltrimethyl-, chloride ester with 4-chloro-2-hydroxymethyl-2-phenyl-1,3-indandione, [2-[(4-Chloro-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazaniumchloride, [2-[(4-chloro-1,3-dioxo-2-phenylinden-2-yl)methoxy]-2-oxoethyl]-trimethylazanium chloride
Technical Specifications
| Molecular Formula | C21H21Cl2NO4 |
| Molecular Weight | 421.08478 g/mol |
| XLogP | -0.09 |
| Topological Polar Surface Area (TPSA) | 60.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 421.08478 Da |
| Heavy Atoms | 28 |
| Complexity | 608.0 |
| SMILES | C[N+](C)(C)CC(=O)OCC1(C(=O)C2=C(C1=O)C(=CC=C2)Cl)C3=CC=CC=C3.[Cl-] |
| InChIKey | KGUHVOXTBBXBOU-UHFFFAOYSA-M |
Chemical Property Profile of RefChem:319194
Property Insights of RefChem:319194
The XLogP value of -0.09 indicates that RefChem:319194 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 60.4 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:319194. Following Lipinski's Rule of Five, RefChem:319194 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:319194?
The CAS number of RefChem:319194 is 42223-04-1.
What is the molecular formula of RefChem:319194?
The molecular formula of RefChem:319194 is C21H21Cl2NO4.
What is the molecular weight of RefChem:319194?
The molecular weight of RefChem:319194 is 421.08478 g/mol.
Where can I buy RefChem:319194?
You can request a quote for RefChem:319194 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:319194?
Yes, CoreyChem provides custom synthesis services for RefChem:319194 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.