Bis(2-chloroethyl) methylphosphonate
TL;DR: Bis(2-chloroethyl) methylphosphonate (CAS 2799-58-8) is a chemical compound with molecular formula C5H11Cl2O3P and molecular weight 219.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-2-[2-chloroethoxy(methyl)phosphoryl]oxyethane
Also Known As: Bis(2-chloroethyl) methylphosphonate, Bis(2-chloroethyl)methylphosphonate, bis(2-chloroethoxy)methylphosphino-1-one, 1-chloro-2-[2-chloroethoxy(methyl)phosphoryl]oxyethane, Bis(2-chloroethyl) methylphosphonate, 95%
| Molecular Formula | C5H11Cl2O3P |
|---|---|
| Molecular Weight | 219.98 g/mol |
| LogP | 2.3201 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 219.98228 |
| Heavy Atoms | 11 |
| Complexity | 129.68922 |
Chemical Identifiers
| CAS Number | 2799-58-8 |
|---|---|
| SMILES | CP(=O)(OCCCl)OCCCl |
Product Overview
Bis(2-chloroethyl) methylphosphonate (CAS 2799-58-8), with molecular formula C5H11Cl2O3P and molecular weight 219.98 g/mol. IUPAC: 1-chloro-2-[2-chloroethoxy(methyl)phosphoryl]oxyethane.
Chemical Property Profile of Bis(2-chloroethyl) methylphosphonate
Property Insights of Bis(2-chloroethyl) methylphosphonate
The XLogP value of 2.3201 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bis(2-chloroethyl) methylphosphonate. With a topological polar surface area (TPSA) of 35.53 Ų, Bis(2-chloroethyl) methylphosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bis(2-chloroethyl) methylphosphonate has 0 hydrogen bond donor(s) and 3 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 Bis(2-chloroethyl) methylphosphonate?
The CAS number of Bis(2-chloroethyl) methylphosphonate is 2799-58-8.
What is the molecular formula of Bis(2-chloroethyl) methylphosphonate?
The molecular formula of Bis(2-chloroethyl) methylphosphonate is C5H11Cl2O3P.
What is the molecular weight of Bis(2-chloroethyl) methylphosphonate?
The molecular weight of Bis(2-chloroethyl) methylphosphonate is 219.98 g/mol.
Where can I buy Bis(2-chloroethyl) methylphosphonate?
You can request a quote for Bis(2-chloroethyl) methylphosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(2-chloroethyl) methylphosphonate?
Yes, KEHONG BIO provides custom synthesis services for Bis(2-chloroethyl) methylphosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.