2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp
TL;DR: 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp (CAS 141096-03-9) is a chemical compound with molecular formula C16H13N11O13P- and molecular weight 598.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3aR,4R,6R,6aR)-4-(6-amino-8-azidopurin-9-yl)-1',2',4'-trinitrospiro[3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-2,5'-cyclohexa-1,3-diene]-6-yl]methyl hydrogen phosphate
Also Known As: Tnp-8-azido-amp, 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp, 8-Azido-2',3'-O-(2,4,6-trinitro-2,4-cyclohexadien-1-ylidene)-5'-adenylic acid ion(1-), 5'-Adenylic acid, 8-azido-2',3'-O-(2,4,6-trinitro-2,4-cyclohexadien-1-ylidene)-, ion(1-), [(3aR,4R,6R,6aR)-4-(6-amino-8-azidopurin-9-yl)-1',2',4'-trinitrospiro[3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-2,5'-cyclohexa-1,3-diene]-6-yl]methyl hydrogen phosphate
| Molecular Formula | C16H13N11O13P- |
|---|---|
| Molecular Weight | 598.04 g/mol |
| LogP | -0.4654 |
| Topological Polar Surface Area | 345.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 8 |
| Exact Mass | 598.0432 |
| Heavy Atoms | 41 |
| Complexity | 1661.6865 |
Chemical Identifiers
| CAS Number | 141096-03-9 |
|---|---|
| SMILES | C1C(=C(C=C(C12O[C@@H]3[C@H](O[C@H]([C@@H]3O2)N4C5=NC=NC(=C5N=C4N=[N+]=[N-])N)COP(=O)(O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp (CAS 141096-03-9), with molecular formula C16H13N11O13P- and molecular weight 598.04 g/mol. IUPAC: [(3aR,4R,6R,6aR)-4-(6-amino-8-azidopurin-9-yl)-1',2',4'-trinitrospiro[3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxole-2,5'-cyclohexa-1,3-diene]-6-yl]methyl hydrogen phosphate.
Chemical Property Profile of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp
Property Insights of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp
The XLogP value of -0.4654 indicates that 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 345.08 Ų indicates high polarity, suggesting 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp has 2 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp?
The CAS number of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp is 141096-03-9.
What is the molecular formula of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp?
The molecular formula of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp is C16H13N11O13P-.
What is the molecular weight of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp?
The molecular weight of 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp is 598.04 g/mol.
Where can I buy 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp?
You can request a quote for 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp?
Yes, KEHONG BIO provides custom synthesis services for 2',3'-O-(2,4,6-Trinitrophenyl)-8-azido-amp and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.