6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine
TL;DR: 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine (CAS 97398-63-5) is a chemical compound with molecular formula C8H6ClNO4 and molecular weight 215.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-7-nitro-2,3-dihydro-1,4-benzodioxine
Also Known As: 6-chloro-7-nitro-2,3-dihydro-1,4-benzodioxine, 6-chloro-7-nitro-2,3-dihydrobenzo[b][1,4]dioxine
| Molecular Formula | C8H6ClNO4 |
|---|---|
| Molecular Weight | 215.00 g/mol |
| LogP | 2.0194 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 214.99854 |
| Heavy Atoms | 14 |
| Complexity | 393.17282 |
Chemical Identifiers
| CAS Number | 97398-63-5 |
|---|---|
| SMILES | C1COC2=C(O1)C=C(C(=C2)Cl)[N+](=O)[O-] |
Product Overview
6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine (CAS 97398-63-5), with molecular formula C8H6ClNO4 and molecular weight 215.00 g/mol. IUPAC: 6-chloro-7-nitro-2,3-dihydro-1,4-benzodioxine.
Chemical Property Profile of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine
Property Insights of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine
The XLogP value of 2.0194 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine. Following Lipinski's Rule of Five, 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine has 0 hydrogen bond donor(s) and 4 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-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine?
The CAS number of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine is 97398-63-5.
What is the molecular formula of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine?
The molecular formula of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine is C8H6ClNO4.
What is the molecular weight of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine?
The molecular weight of 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine is 215.00 g/mol.
Where can I buy 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine?
You can request a quote for 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-7-nitro-2,3-dihydro-1,4-benzodioxine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.