4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole
TL;DR: 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole (CAS 185253-69-4) is a chemical compound with molecular formula C6HCl2N3O3 and molecular weight 232.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-5-nitro-2,1,3-benzoxadiazole
Also Known As: 4,6-dichloro-5-nitro-2,1,3-benzoxadiazole, BAS 01237180, 4,6-Dichloro-5-nitro-benzo[1,2,5]oxadiazole, 2,1,3-Benzoxadiazole, 4,6-dichloro-5-nitro-, 4,6-dichloro-5-nitrobenzo[c][1,2,5]oxadiazole
| Molecular Formula | C6HCl2N3O3 |
|---|---|
| Molecular Weight | 232.94 g/mol |
| LogP | 2.4378 |
| Topological Polar Surface Area | 82.06 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 232.9395 |
| Heavy Atoms | 14 |
| Complexity | 524.2612 |
Chemical Identifiers
| CAS Number | 185253-69-4 |
|---|---|
| SMILES | C1=C(C(=C(C2=NON=C21)Cl)[N+](=O)[O-])Cl |
Product Overview
4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole (CAS 185253-69-4), with molecular formula C6HCl2N3O3 and molecular weight 232.94 g/mol. IUPAC: 4,6-dichloro-5-nitro-2,1,3-benzoxadiazole.
Chemical Property Profile of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole
Property Insights of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole
The XLogP value of 2.4378 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole. The TPSA of 82.06 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole. Following Lipinski's Rule of Five, 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole 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
Frequently Asked Questions
What is the CAS number of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole?
The CAS number of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole is 185253-69-4.
What is the molecular formula of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole?
The molecular formula of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole is C6HCl2N3O3.
What is the molecular weight of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole?
The molecular weight of 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole is 232.94 g/mol.
Where can I buy 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole?
You can request a quote for 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole?
Yes, KEHONG BIO provides custom synthesis services for 4,6-Dichloro-5-nitro-2,1,3-benzoxadiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.