双(2,4-二硝基苯基)碳酸酯
TL;DR: 双(2,4-二硝基苯基)碳酸酯 (CAS 7497-12-3) is a chemical compound with molecular formula C13H6N4O11 and molecular weight 394.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
双(2,4-二硝基苯基)碳酸酯
bis(2,4-dinitrophenyl) carbonate
Also Known As: Bis(2,4-dinitrophenyl)carbonate, Bis(2,4-Dinitrophenyl) carbonate, BDPC, 7-Aminobutyric Acid, bis-(2,4-dinitrophenyl)carbonate
| Molecular Formula | C13H6N4O11 |
|---|---|
| Molecular Weight | 394.00 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 219.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 394.0033 |
| Heavy Atoms | 28 |
| Complexity | 595.0 |
Chemical Identifiers
| CAS Number | 7497-12-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])OC(=O)OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | VJAMBZRWYAAZSN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
双(2,4-二硝基苯基)碳酸酯 (CAS 7497-12-3), with molecular formula C13H6N4O11 and molecular weight 394.00 g/mol. IUPAC: bis(2,4-dinitrophenyl) carbonate.
Chemical Property Profile of 双(2,4-二硝基苯基)碳酸酯
Property Insights of 双(2,4-二硝基苯基)碳酸酯
The XLogP value of 3.0 indicates that 双(2,4-二硝基苯基)碳酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 219.0 Ų indicates high polarity, suggesting 双(2,4-二硝基苯基)碳酸酯 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 双(2,4-二硝基苯基)碳酸酯 has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 双(2,4-二硝基苯基)碳酸酯?
The CAS number of 双(2,4-二硝基苯基)碳酸酯 is 7497-12-3.
What is the molecular formula of 双(2,4-二硝基苯基)碳酸酯?
The molecular formula of 双(2,4-二硝基苯基)碳酸酯 is C13H6N4O11.
What is the molecular weight of 双(2,4-二硝基苯基)碳酸酯?
The molecular weight of 双(2,4-二硝基苯基)碳酸酯 is 394.00 g/mol.
Where can I buy 双(2,4-二硝基苯基)碳酸酯?
You can request a quote for 双(2,4-二硝基苯基)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(2,4-二硝基苯基)碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 双(2,4-二硝基苯基)碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.