Phosphonic acid, (aminocyanomethyl)-, diethyl ester
TL;DR: Phosphonic acid, (aminocyanomethyl)-, diethyl ester (CAS 69907-48-8) is a chemical compound with molecular formula C6H13N2O3P and molecular weight 192.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-2-diethoxyphosphorylacetonitrile
Also Known As: 2-amino-2-diethoxyphosphorylacetonitrile, Diethyl [amino(cyano)methyl]phosphonate, Phosphonic acid, (aminocyanomethyl)-, diethyl ester, 2-amino-2-diethoxyphosphoryl-acetonitrile, RefChem:370513
| Molecular Formula | C6H13N2O3P |
|---|---|
| Molecular Weight | 192.07 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 85.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 192.06638 |
| Heavy Atoms | 12 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 69907-48-8 |
|---|---|
| SMILES | CCOP(=O)(C(C#N)N)OCC |
| InChIKey | PBWNQPLPIXXHGN-UHFFFAOYSA-N |
Product Overview
Phosphonic acid, (aminocyanomethyl)-, diethyl ester (CAS 69907-48-8), with molecular formula C6H13N2O3P and molecular weight 192.07 g/mol. IUPAC: 2-amino-2-diethoxyphosphorylacetonitrile.
Chemical Property Profile of Phosphonic acid, (aminocyanomethyl)-, diethyl ester
Property Insights of Phosphonic acid, (aminocyanomethyl)-, diethyl ester
The XLogP value of -0.8 indicates that Phosphonic acid, (aminocyanomethyl)-, diethyl ester is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 85.3 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonic acid, (aminocyanomethyl)-, diethyl ester. Following Lipinski's Rule of Five, Phosphonic acid, (aminocyanomethyl)-, diethyl ester has 1 hydrogen bond donor(s) and 5 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 Phosphonic acid, (aminocyanomethyl)-, diethyl ester?
The CAS number of Phosphonic acid, (aminocyanomethyl)-, diethyl ester is 69907-48-8.
What is the molecular formula of Phosphonic acid, (aminocyanomethyl)-, diethyl ester?
The molecular formula of Phosphonic acid, (aminocyanomethyl)-, diethyl ester is C6H13N2O3P.
What is the molecular weight of Phosphonic acid, (aminocyanomethyl)-, diethyl ester?
The molecular weight of Phosphonic acid, (aminocyanomethyl)-, diethyl ester is 192.07 g/mol.
Where can I buy Phosphonic acid, (aminocyanomethyl)-, diethyl ester?
You can request a quote for Phosphonic acid, (aminocyanomethyl)-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonic acid, (aminocyanomethyl)-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonic acid, (aminocyanomethyl)-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.