RefChem:365453
TL;DR: RefChem:365453 (CAS 101931-42-4) is a chemical compound with molecular formula C16H19Cl2NO2 and molecular weight 327.07928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloroethyl-(2,3-dihydrobenzo[g][1,4]benzodioxin-3-ylmethyl)-methylazanium chloride
Also Known As: Naphtho(2,3-b)-p-dioxin-2-methylamine, 2,3-dihydro-N-(2-chloroethyl)-N-methyl-, hydrochloride, 2-(N-(2-Chloroethyl)-N-methylaminomethyl)-1,4-naphthodioxan hydrochloride, 2,3-Dihydro-N-(2-chloroethyl)-N-methyl-naphtho(2,3-b)-p-dioxin-2-methylamine hydrochloride, 2-chloro-n-(2,3-dihydronaphtho[2,3-b][1,4]dioxin-2-ylmethyl)-n-methylethanaminium chloride, 2-chloroethyl-(2,3-dihydrobenzo[g][1,4]benzodioxin-3-ylmethyl)-methylazanium chloride
Technical Specifications
| Molecular Formula | C16H19Cl2NO2 |
| Molecular Weight | 327.07928 g/mol |
| XLogP | -1.26 |
| Topological Polar Surface Area (TPSA) | 22.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 327.07928 Da |
| Heavy Atoms | 21 |
| Complexity | 315.0 |
| SMILES | C[NH+](CCCl)CC1COC2=CC3=CC=CC=C3C=C2O1.[Cl-] |
| InChIKey | OZZVIILCEQANCF-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:365453
Property Insights of RefChem:365453
The XLogP value of -1.26 indicates that RefChem:365453 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 22.9 Ų, RefChem:365453 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:365453 has 1 hydrogen bond donor(s) and 3 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:365453?
The CAS number of RefChem:365453 is 101931-42-4.
What is the molecular formula of RefChem:365453?
The molecular formula of RefChem:365453 is C16H19Cl2NO2.
What is the molecular weight of RefChem:365453?
The molecular weight of RefChem:365453 is 327.07928 g/mol.
Where can I buy RefChem:365453?
You can request a quote for RefChem:365453 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:365453?
Yes, CoreyChem provides custom synthesis services for RefChem:365453 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.