2,2,2-trichloro-1-dipropoxyphosphorylethanol
TL;DR: 2,2,2-trichloro-1-dipropoxyphosphorylethanol (CAS 996-43-0) is a chemical compound with molecular formula C8H16Cl3O4P and molecular weight 311.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,2-trichloro-1-dipropoxyphosphorylethanol
Also Known As: 2,2,2-trichloro-1-dipropoxyphosphorylethanol, 2,2,2-trichloro-1-dipropoxyphosphoryl-ethanol, Dipropyl (2,2,2-trichloro-1-hydroxyethyl)phosphonate, phosphinodipropoxy(2,2,2-trichloro-1-hydroxyethyl)-1-one, RefChem:381833
| Molecular Formula | C8H16Cl3O4P |
|---|---|
| Molecular Weight | 311.99 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.98517 |
| Heavy Atoms | 16 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 996-43-0 |
|---|---|
| SMILES | CCCOP(=O)(C(C(Cl)(Cl)Cl)O)OCCC |
| InChIKey | PLRCDCWUOQDVNO-UHFFFAOYSA-N |
Product Overview
2,2,2-trichloro-1-dipropoxyphosphorylethanol (CAS 996-43-0), with molecular formula C8H16Cl3O4P and molecular weight 311.99 g/mol. IUPAC: 2,2,2-trichloro-1-dipropoxyphosphorylethanol.
Chemical Property Profile of 2,2,2-trichloro-1-dipropoxyphosphorylethanol
Property Insights of 2,2,2-trichloro-1-dipropoxyphosphorylethanol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2,2-trichloro-1-dipropoxyphosphorylethanol. With a topological polar surface area (TPSA) of 55.8 Ų, 2,2,2-trichloro-1-dipropoxyphosphorylethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2,2-trichloro-1-dipropoxyphosphorylethanol 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 2,2,2-trichloro-1-dipropoxyphosphorylethanol?
The CAS number of 2,2,2-trichloro-1-dipropoxyphosphorylethanol is 996-43-0.
What is the molecular formula of 2,2,2-trichloro-1-dipropoxyphosphorylethanol?
The molecular formula of 2,2,2-trichloro-1-dipropoxyphosphorylethanol is C8H16Cl3O4P.
What is the molecular weight of 2,2,2-trichloro-1-dipropoxyphosphorylethanol?
The molecular weight of 2,2,2-trichloro-1-dipropoxyphosphorylethanol is 311.99 g/mol.
Where can I buy 2,2,2-trichloro-1-dipropoxyphosphorylethanol?
You can request a quote for 2,2,2-trichloro-1-dipropoxyphosphorylethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2,2-trichloro-1-dipropoxyphosphorylethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2,2-trichloro-1-dipropoxyphosphorylethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.