双(4-硝基苯基)碳酸酯
TL;DR: 双(4-硝基苯基)碳酸酯 (CAS 5070-13-3) is a chemical compound with molecular formula C13H8N2O7 and molecular weight 304.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双(4-硝基苯基)碳酸酯
bis(4-nitrophenyl) carbonate
Also Known As: Bis(4-nitrophenyl) carbonate, Bis(4-nitrophenyl)carbonate, Bis(p-nitrophenyl) carbonate, bis carbonate, 4-Nitrophenyl carbonate
| Molecular Formula | C13H8N2O7 |
|---|---|
| Molecular Weight | 304.03 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 304.03314 |
| Heavy Atoms | 22 |
| Complexity | 377.0 |
Chemical Identifiers
| CAS Number | 5070-13-3 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC(=O)OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | ACBQROXDOHKANW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双(4-硝基苯基)碳酸酯 (CAS 5070-13-3), with molecular formula C13H8N2O7 and molecular weight 304.03 g/mol. IUPAC: bis(4-nitrophenyl) carbonate.
Chemical Property Profile of 双(4-硝基苯基)碳酸酯
Property Insights of 双(4-硝基苯基)碳酸酯
The XLogP value of 3.3 indicates that 双(4-硝基苯基)碳酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 双(4-硝基苯基)碳酸酯. Following Lipinski's Rule of Five, 双(4-硝基苯基)碳酸酯 has 0 hydrogen bond donor(s) and 7 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 双(4-硝基苯基)碳酸酯?
The CAS number of 双(4-硝基苯基)碳酸酯 is 5070-13-3.
What is the molecular formula of 双(4-硝基苯基)碳酸酯?
The molecular formula of 双(4-硝基苯基)碳酸酯 is C13H8N2O7.
What is the molecular weight of 双(4-硝基苯基)碳酸酯?
The molecular weight of 双(4-硝基苯基)碳酸酯 is 304.03 g/mol.
Where can I buy 双(4-硝基苯基)碳酸酯?
You can request a quote for 双(4-硝基苯基)碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 双(4-硝基苯基)碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 双(4-硝基苯基)碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.