2,4-二硝基苯基丁基碳酸酯
TL;DR: 2,4-二硝基苯基丁基碳酸酯 (CAS 15741-91-0) is a chemical compound with molecular formula C11H12N2O7 and molecular weight 284.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-二硝基苯基丁基碳酸酯
butyl (2,4-dinitrophenyl) carbonate
Also Known As: Stauffer R-10669, Butyl 2,4-dinitrophenyl carbonate, butyl (2,4-dinitrophenyl) carbonate, ENT 27,364, Carbonic acid 2,4-dinitrophenyl(butyl) ester
| Molecular Formula | C11H12N2O7 |
|---|---|
| Molecular Weight | 284.06 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 284.06445 |
| Heavy Atoms | 20 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 15741-91-0 |
|---|---|
| SMILES | CCCCOC(=O)OC1=C(C=C(C=C1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | UKVCWXQPMRARHZ-UHFFFAOYSA-N |
Product Overview
2,4-二硝基苯基丁基碳酸酯 (CAS 15741-91-0), with molecular formula C11H12N2O7 and molecular weight 284.06 g/mol. IUPAC: butyl (2,4-dinitrophenyl) carbonate.
Chemical Property Profile of 2,4-二硝基苯基丁基碳酸酯
Property Insights of 2,4-二硝基苯基丁基碳酸酯
The XLogP value of 3.0 indicates that 2,4-二硝基苯基丁基碳酸酯 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 2,4-二硝基苯基丁基碳酸酯. Following Lipinski's Rule of Five, 2,4-二硝基苯基丁基碳酸酯 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 2,4-二硝基苯基丁基碳酸酯?
The CAS number of 2,4-二硝基苯基丁基碳酸酯 is 15741-91-0.
What is the molecular formula of 2,4-二硝基苯基丁基碳酸酯?
The molecular formula of 2,4-二硝基苯基丁基碳酸酯 is C11H12N2O7.
What is the molecular weight of 2,4-二硝基苯基丁基碳酸酯?
The molecular weight of 2,4-二硝基苯基丁基碳酸酯 is 284.06 g/mol.
Where can I buy 2,4-二硝基苯基丁基碳酸酯?
You can request a quote for 2,4-二硝基苯基丁基碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-二硝基苯基丁基碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2,4-二硝基苯基丁基碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.