2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide
TL;DR: 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide (CAS 15944-77-1) is a chemical compound with molecular formula C6H2Cl2N2O2 and molecular weight 203.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,6-dichloro-1-oxido-2,1,3-benzoxadiazol-1-ium
Also Known As: 4,6-dichlorobenzofuroxan, 4,6-Dichlorobenzofurazane 1-oxide, 4,6-dichloro-1-oxido-2,1,3-benzoxadiazol-1-ium, 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide, 4,6-dichloro-2,1,3-benzoxadiazol-1-ium-1-olate
| Molecular Formula | C6H2Cl2N2O2 |
|---|---|
| Molecular Weight | 203.95 g/mol |
| LogP | 1.768 |
| Topological Polar Surface Area | 52.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 203.94933 |
| Heavy Atoms | 12 |
| Complexity | 440.28586 |
Chemical Identifiers
| CAS Number | 15944-77-1 |
|---|---|
| SMILES | C1=C(C=C(C2=NO[N+](=C21)[O-])Cl)Cl |
Product Overview
2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide (CAS 15944-77-1), with molecular formula C6H2Cl2N2O2 and molecular weight 203.95 g/mol. IUPAC: 4,6-dichloro-1-oxido-2,1,3-benzoxadiazol-1-ium.
Chemical Property Profile of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide
Property Insights of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide
The XLogP value of 1.768 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide. With a topological polar surface area (TPSA) of 52.97 Ų, 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide has 0 hydrogen bond donor(s) and 3 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 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide?
The CAS number of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide is 15944-77-1.
What is the molecular formula of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide?
The molecular formula of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide is C6H2Cl2N2O2.
What is the molecular weight of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide?
The molecular weight of 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide is 203.95 g/mol.
Where can I buy 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide?
You can request a quote for 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 2,1,3-Benzoxadiazole, 4,6-dichloro-, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.