![萘[2,1-d]-1,2,3-噁二唑-5-磺酸 structure](/static/products/1177/117-70-4.webp)
萘[2,1-d]-1,2,3-噁二唑-5-磺酸
TL;DR: 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 (CAS 117-70-4) is a chemical compound with molecular formula C10H6N2O4S and molecular weight 250.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
萘[2,1-d]-1,2,3-噁二唑-5-磺酸
benzo[g][1,2,3]benzoxadiazole-5-sulfonic acid
Also Known As: benzo[g][1,2,3]benzoxadiazole-5-sulfonic acid, naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonic acid, Naphth(2,1-d)-1,2,3-oxadiazole-5-sulfonic acid, naphth[2,1-d]-1,2,3-oxadiazole-5-sulphonic acid, Naphth[2,1-d]-1,2,3-oxadiazole-5-sulfonicacid
| Molecular Formula | C10H6N2O4S |
|---|---|
| Molecular Weight | 250.00 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 250.00482 |
| Heavy Atoms | 17 |
| Complexity | 394.0 |
Chemical Identifiers
| CAS Number | 117-70-4 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC3=C2ON=N3)S(=O)(=O)O |
| InChIKey | OIDKWKZBMQUGNQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
萘[2,1-d]-1,2,3-噁二唑-5-磺酸 (CAS 117-70-4), with molecular formula C10H6N2O4S and molecular weight 250.00 g/mol. IUPAC: benzo[g][1,2,3]benzoxadiazole-5-sulfonic acid.
Chemical Property Profile of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸
Property Insights of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 萘[2,1-d]-1,2,3-噁二唑-5-磺酸. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 萘[2,1-d]-1,2,3-噁二唑-5-磺酸. Following Lipinski's Rule of Five, 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 has 1 hydrogen bond donor(s) and 6 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 萘[2,1-d]-1,2,3-噁二唑-5-磺酸?
The CAS number of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 is 117-70-4.
What is the molecular formula of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸?
The molecular formula of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 is C10H6N2O4S.
What is the molecular weight of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸?
The molecular weight of 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 is 250.00 g/mol.
Where can I buy 萘[2,1-d]-1,2,3-噁二唑-5-磺酸?
You can request a quote for 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 萘[2,1-d]-1,2,3-噁二唑-5-磺酸?
Yes, KEHONG BIO provides custom synthesis services for 萘[2,1-d]-1,2,3-噁二唑-5-磺酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.