4-Diazophenylphosphocholine
TL;DR: 4-Diazophenylphosphocholine (CAS 71691-31-1) is a chemical compound with molecular formula C11H18N3O4P and molecular weight 287.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl]oxyphenyl]iminoazanide
Also Known As: 4-Diazophenylphosphocholine, KST-1A7806, [4-({hydroxy[2-(trimethylammonio)ethoxy]phosphoryl}oxy)phenyl]diazenide, [4-(hydroxy-(2-trimethylammonioethoxy)phosphoryl)oxyphenyl]iminoazanide, [4-[hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl]oxyphenyl]iminoazanide
| Molecular Formula | C11H18N3O4P |
|---|---|
| Molecular Weight | 287.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 69.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 287.1035 |
| Heavy Atoms | 19 |
| Complexity | 337.0 |
Chemical Identifiers
| CAS Number | 71691-31-1 |
|---|---|
| SMILES | C[N+](C)(C)CCOP(=O)(O)OC1=CC=C(C=C1)N=[N-] |
| InChIKey | FSWISKGAILWSGB-UHFFFAOYSA-N |
Product Overview
4-Diazophenylphosphocholine (CAS 71691-31-1), with molecular formula C11H18N3O4P and molecular weight 287.10 g/mol. IUPAC: [4-[hydroxy-[2-(trimethylazaniumyl)ethoxy]phosphoryl]oxyphenyl]iminoazanide.
Chemical Property Profile of 4-Diazophenylphosphocholine
Property Insights of 4-Diazophenylphosphocholine
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Diazophenylphosphocholine. The TPSA of 69.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Diazophenylphosphocholine. Following Lipinski's Rule of Five, 4-Diazophenylphosphocholine has 1 hydrogen bond donor(s) and 6 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 4-Diazophenylphosphocholine?
The CAS number of 4-Diazophenylphosphocholine is 71691-31-1.
What is the molecular formula of 4-Diazophenylphosphocholine?
The molecular formula of 4-Diazophenylphosphocholine is C11H18N3O4P.
What is the molecular weight of 4-Diazophenylphosphocholine?
The molecular weight of 4-Diazophenylphosphocholine is 287.10 g/mol.
Where can I buy 4-Diazophenylphosphocholine?
You can request a quote for 4-Diazophenylphosphocholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Diazophenylphosphocholine?
Yes, KEHONG BIO provides custom synthesis services for 4-Diazophenylphosphocholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.