TL;DR: Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- (CAS 101126-64-1) is a chemical compound with molecular formula C12H6ClNO4 and molecular weight 262.99854 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-chloro-8-nitrodibenzo-p-dioxin
Also Known As: 2-chloro-8-nitrooxanthrene, 2-chloro-8-nitrodibenzo-p-dioxin, 2-Chloro-8-nitrodibenzo(b,e)(1,4)dioxin, Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro-
| Molecular Formula | C12H6ClNO4 |
| Molecular Weight | 262.99854 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 64.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 262.99854 Da |
| Heavy Atoms | 18 |
| Complexity | 335.0 |
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])OC3=C(O2)C=CC(=C3)Cl |
| InChIKey | VZIBZXBMTCZVMJ-UHFFFAOYSA-N |
The XLogP value of 3.5 indicates that Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro-. Following Lipinski's Rule of Five, Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- is 101126-64-1.
The molecular formula of Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- is C12H6ClNO4.
The molecular weight of Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- is 262.99854 g/mol.
You can request a quote for Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Yes, CoreyChem provides custom synthesis services for Dibenzo(b,e)(1,4)dioxin, 2-chloro-8-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
Request a quote for CAS 101126-64-1. Our professional technical team will respond with pricing and lead time.