2-Azidophenethyl pyrophosphate
TL;DR: 2-Azidophenethyl pyrophosphate (CAS 69258-91-9) is a chemical compound with molecular formula C8H11N3O7P2 and molecular weight 323.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-azidophenyl)ethyl phosphono hydrogen phosphate
Also Known As: 2-Azidophenethyl pyrophosphate, 2-azidophenethylpyrophosphate, 2-(2-azidophenyl)ethyl trihydrogen diphosphate, 2-(2-azidophenyl)ethyl phosphono hydrogen phosphate, Diphosphoric acid, mono(2-(2-azidophenyl)ethyl) ester
| Molecular Formula | C8H11N3O7P2 |
|---|---|
| Molecular Weight | 323.01 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 128.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 323.00723 |
| Heavy Atoms | 20 |
| Complexity | 461.0 |
Chemical Identifiers
| CAS Number | 69258-91-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CCOP(=O)(O)OP(=O)(O)O)N=[N+]=[N-] |
| InChIKey | LHEIQCWYKQFPPV-UHFFFAOYSA-N |
Product Overview
2-Azidophenethyl pyrophosphate (CAS 69258-91-9), with molecular formula C8H11N3O7P2 and molecular weight 323.01 g/mol. IUPAC: 2-(2-azidophenyl)ethyl phosphono hydrogen phosphate.
Chemical Property Profile of 2-Azidophenethyl pyrophosphate
Property Insights of 2-Azidophenethyl pyrophosphate
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Azidophenethyl pyrophosphate. The TPSA of 128.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Azidophenethyl pyrophosphate. Following Lipinski's Rule of Five, 2-Azidophenethyl pyrophosphate has 3 hydrogen bond donor(s) and 9 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-Azidophenethyl pyrophosphate?
The CAS number of 2-Azidophenethyl pyrophosphate is 69258-91-9.
What is the molecular formula of 2-Azidophenethyl pyrophosphate?
The molecular formula of 2-Azidophenethyl pyrophosphate is C8H11N3O7P2.
What is the molecular weight of 2-Azidophenethyl pyrophosphate?
The molecular weight of 2-Azidophenethyl pyrophosphate is 323.01 g/mol.
Where can I buy 2-Azidophenethyl pyrophosphate?
You can request a quote for 2-Azidophenethyl pyrophosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Azidophenethyl pyrophosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Azidophenethyl pyrophosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.