20,21,24,25-Tetranitro-dibenzo-18-crown-6
TL;DR: 20,21,24,25-Tetranitro-dibenzo-18-crown-6 (CAS 61853-51-8) is a chemical compound with molecular formula C20H20N4O14 and molecular weight 540.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
11,12,24,25-tetranitro-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene
Also Known As: 20,21,24,25-Tetranitro-dibenzo-18-crown-6, J1.552.041H, 4,4,5,5-TETRANITRODIBENZO-18-CROWN-6, 1,2-[(4,5-Dinitro-o-phenylene)bis(oxyethyleneoxyethyleneoxy)]-4,5-dinitrobenzene, 11,12,24,25-tetranitro-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9,11,13,23,25-hexaene
| Molecular Formula | C20H20N4O14 |
|---|---|
| Molecular Weight | 540.10 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 239.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 0 |
| Exact Mass | 540.0976 |
| Heavy Atoms | 38 |
| Complexity | 682.0 |
Chemical Identifiers
| CAS Number | 61853-51-8 |
|---|---|
| SMILES | C1COC2=C(C=C(C(=C2)[N+](=O)[O-])[N+](=O)[O-])OCCOCCOC3=C(C=C(C(=C3)[N+](=O)[O-])[N+](=O)[O-])OCCO1 |
| InChIKey | WTOLDNXPOLMLPN-UHFFFAOYSA-N |
Product Overview
20,21,24,25-Tetranitro-dibenzo-18-crown-6 (CAS 61853-51-8), with molecular formula C20H20N4O14 and molecular weight 540.10 g/mol. IUPAC: 11,12,24,25-tetranitro-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene.
Chemical Property Profile of 20,21,24,25-Tetranitro-dibenzo-18-crown-6
Property Insights of 20,21,24,25-Tetranitro-dibenzo-18-crown-6
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 20,21,24,25-Tetranitro-dibenzo-18-crown-6. The TPSA of 239.0 Ų indicates high polarity, suggesting 20,21,24,25-Tetranitro-dibenzo-18-crown-6 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 20,21,24,25-Tetranitro-dibenzo-18-crown-6 has 0 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 20,21,24,25-Tetranitro-dibenzo-18-crown-6?
The CAS number of 20,21,24,25-Tetranitro-dibenzo-18-crown-6 is 61853-51-8.
What is the molecular formula of 20,21,24,25-Tetranitro-dibenzo-18-crown-6?
The molecular formula of 20,21,24,25-Tetranitro-dibenzo-18-crown-6 is C20H20N4O14.
What is the molecular weight of 20,21,24,25-Tetranitro-dibenzo-18-crown-6?
The molecular weight of 20,21,24,25-Tetranitro-dibenzo-18-crown-6 is 540.10 g/mol.
Where can I buy 20,21,24,25-Tetranitro-dibenzo-18-crown-6?
You can request a quote for 20,21,24,25-Tetranitro-dibenzo-18-crown-6 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 20,21,24,25-Tetranitro-dibenzo-18-crown-6?
Yes, KEHONG BIO provides custom synthesis services for 20,21,24,25-Tetranitro-dibenzo-18-crown-6 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.