Dimethyl trichloromethyl phosphonate
TL;DR: Dimethyl trichloromethyl phosphonate (CAS 29238-81-1) is a chemical compound with molecular formula C3H6Cl3O3P and molecular weight 225.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
trichloro(dimethoxyphosphoryl)methane
Also Known As: dimethyl trichloromethyl phosphonate, trichloro(dimethoxyphosphoryl)methane, dimethyl (trichloromethyl)phosphonate, Trichloromethylphosphonic acid dimethyl ester, J1.649.413E
| Molecular Formula | C3H6Cl3O3P |
|---|---|
| Molecular Weight | 225.91 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 225.91202 |
| Heavy Atoms | 10 |
| Complexity | 145.56215 |
Chemical Identifiers
| CAS Number | 29238-81-1 |
|---|---|
| SMILES | COP(=O)(C(Cl)(Cl)Cl)OC |
Product Overview
Dimethyl trichloromethyl phosphonate (CAS 29238-81-1), with molecular formula C3H6Cl3O3P and molecular weight 225.91 g/mol. IUPAC: trichloro(dimethoxyphosphoryl)methane.
Chemical Property Profile of Dimethyl trichloromethyl phosphonate
Property Insights of Dimethyl trichloromethyl phosphonate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl trichloromethyl phosphonate. With a topological polar surface area (TPSA) of 35.53 Ų, Dimethyl trichloromethyl phosphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dimethyl trichloromethyl phosphonate 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 Dimethyl trichloromethyl phosphonate?
The CAS number of Dimethyl trichloromethyl phosphonate is 29238-81-1.
What is the molecular formula of Dimethyl trichloromethyl phosphonate?
The molecular formula of Dimethyl trichloromethyl phosphonate is C3H6Cl3O3P.
What is the molecular weight of Dimethyl trichloromethyl phosphonate?
The molecular weight of Dimethyl trichloromethyl phosphonate is 225.91 g/mol.
Where can I buy Dimethyl trichloromethyl phosphonate?
You can request a quote for Dimethyl trichloromethyl phosphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl trichloromethyl phosphonate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl trichloromethyl phosphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.