(6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate
TL;DR: (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate (CAS 565224-06-8) is a chemical compound with molecular formula C15H11ClN2O6 and molecular weight 350.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate
Also Known As: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate, (6-nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate
| Molecular Formula | C15H11ClN2O6 |
|---|---|
| Molecular Weight | 350.03 g/mol |
| LogP | 2.8667 |
| Topological Polar Surface Area | 100.79 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.03058 |
| Heavy Atoms | 24 |
| Complexity | 810.54645 |
Chemical Identifiers
| CAS Number | 565224-06-8 |
|---|---|
| SMILES | C1C2=C(C(=CC(=C2)[N+](=O)[O-])COC(=O)C3=C(N=CC=C3)Cl)OCO1 |
Product Overview
(6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate (CAS 565224-06-8), with molecular formula C15H11ClN2O6 and molecular weight 350.03 g/mol. IUPAC: (6-nitro-4H-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate.
Chemical Property Profile of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate
Property Insights of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate
The XLogP value of 2.8667 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate. The TPSA of 100.79 Ų falls within the moderate polarity range, balancing permeability and solubility for (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate. Following Lipinski's Rule of Five, (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate has 0 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 (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate?
The CAS number of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate is 565224-06-8.
What is the molecular formula of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate?
The molecular formula of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate is C15H11ClN2O6.
What is the molecular weight of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate?
The molecular weight of (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate is 350.03 g/mol.
Where can I buy (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate?
You can request a quote for (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (6-Nitro-2,4-dihydro-1,3-benzodioxin-8-yl)methyl 2-chloropyridine-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.