Diethyl (3-aminopropyl)phosphonate
TL;DR: Diethyl (3-aminopropyl)phosphonate (CAS 4402-24-8) is a chemical compound with molecular formula C7H18NO3P and molecular weight 195.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-diethoxyphosphorylpropan-1-amine
Also Known As: Diethyl (3-aminopropyl)phosphonate, 3-diethoxyphosphorylpropan-1-amine, Diethyl phosphonate, starbld0019539, diethyl 3-aminopropylphosphonate
| Molecular Formula | C7H18NO3P |
|---|---|
| Molecular Weight | 195.10 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 195.10243 |
| Heavy Atoms | 12 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 4402-24-8 |
|---|---|
| SMILES | CCOP(=O)(CCCN)OCC |
| InChIKey | DQORFBNFNLHVIM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl (3-aminopropyl)phosphonate (CAS 4402-24-8), with molecular formula C7H18NO3P and molecular weight 195.10 g/mol. IUPAC: 3-diethoxyphosphorylpropan-1-amine.
Chemical Property Profile of Diethyl (3-aminopropyl)phosphonate
Property Insights of Diethyl (3-aminopropyl)phosphonate
The XLogP value of -0.4 indicates that Diethyl (3-aminopropyl)phosphonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl (3-aminopropyl)phosphonate. Following Lipinski's Rule of Five, Diethyl (3-aminopropyl)phosphonate has 1 hydrogen bond donor(s) and 4 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 Diethyl (3-aminopropyl)phosphonate?
The CAS number of Diethyl (3-aminopropyl)phosphonate is 4402-24-8.
What is the molecular formula of Diethyl (3-aminopropyl)phosphonate?
The molecular formula of Diethyl (3-aminopropyl)phosphonate is C7H18NO3P.
What is the molecular weight of Diethyl (3-aminopropyl)phosphonate?
The molecular weight of Diethyl (3-aminopropyl)phosphonate is 195.10 g/mol.
Where can I buy Diethyl (3-aminopropyl)phosphonate?
You can request a quote for Diethyl (3-aminopropyl)phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl (3-aminopropyl)phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl (3-aminopropyl)phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.