Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride
TL;DR: Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride (CAS 301822-79-7) is a chemical compound with molecular formula C11H19Cl2N2O3P and molecular weight 328.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-1-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine;hydrochloride
Also Known As: diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride, DIETHYL METHYLPHOSPHONATEHYDROCHLORIDE, 4-chloro-1-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine;hydrochloride, 4-chloro-1-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine hydrochloride, 4-chloro-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine Hydrochloride
| Molecular Formula | C11H19Cl2N2O3P |
|---|---|
| Molecular Weight | 328.05 g/mol |
| LogP | 3.9795 |
| Topological Polar Surface Area | 73.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 328.05103 |
| Heavy Atoms | 19 |
| Complexity | 435.94852 |
Chemical Identifiers
| CAS Number | 301822-79-7 |
|---|---|
| SMILES | CCOP(=O)(CNC1=C(C=C(C=C1)Cl)N)OCC.Cl |
Product Overview
Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride (CAS 301822-79-7), with molecular formula C11H19Cl2N2O3P and molecular weight 328.05 g/mol. IUPAC: 4-chloro-1-N-(diethoxyphosphorylmethyl)benzene-1,2-diamine;hydrochloride.
Chemical Property Profile of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride
Property Insights of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride
The XLogP value of 3.9795 indicates that Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.58 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride. Following Lipinski's Rule of Five, Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride has 2 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 Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride?
The CAS number of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride is 301822-79-7.
What is the molecular formula of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride?
The molecular formula of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride is C11H19Cl2N2O3P.
What is the molecular weight of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride?
The molecular weight of Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride is 328.05 g/mol.
Where can I buy Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride?
You can request a quote for Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Diethyl (2-amino-4-chloroanilino)methylphosphonate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.