NBD-Cl
TL;DR: NBD-Cl (CAS 10199-89-0) is a chemical compound with molecular formula C6H2ClN3O3 and molecular weight 198.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
NBD-Cl
4-chloro-7-nitro-2,1,3-benzoxadiazole
Also Known As: 4-Chloro-7-nitrobenzofurazan, Nbd chloride, NBD-Cl, NBD-chloride, 4-Chloro-7-nitro-2,1,3-benzoxadiazole
| Molecular Formula | C6H2ClN3O3 |
|---|---|
| Molecular Weight | 198.98 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 198.97847 |
| Heavy Atoms | 13 |
| Complexity | 222.0 |
Chemical Identifiers
| CAS Number | 10199-89-0 |
|---|---|
| SMILES | C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-] |
| InChIKey | IGHBXJSNZCFXNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
NBD-Cl (CAS 10199-89-0), with molecular formula C6H2ClN3O3 and molecular weight 198.98 g/mol. IUPAC: 4-chloro-7-nitro-2,1,3-benzoxadiazole.
Chemical Property Profile of NBD-Cl
Property Insights of NBD-Cl
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for NBD-Cl. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for NBD-Cl. Following Lipinski's Rule of Five, NBD-Cl 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 NBD-Cl?
The CAS number of NBD-Cl is 10199-89-0.
What is the molecular formula of NBD-Cl?
The molecular formula of NBD-Cl is C6H2ClN3O3.
What is the molecular weight of NBD-Cl?
The molecular weight of NBD-Cl is 198.98 g/mol.
Where can I buy NBD-Cl?
You can request a quote for NBD-Cl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for NBD-Cl?
Yes, KEHONG BIO provides custom synthesis services for NBD-Cl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.