2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate
TL;DR: 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate (CAS 3568-51-2) is a chemical compound with molecular formula C6H10Cl3O4P and molecular weight 281.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloroethyl 2,2-dichloroethenyl ethyl phosphate
Also Known As: Bayer 16574, starbld0007565, 2-chloroethyl 2,2-dichloroethenyl ethyl phosphate, BAY 16574, AI 3-22016
| Molecular Formula | C6H10Cl3O4P |
|---|---|
| Molecular Weight | 281.94 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 44.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 281.93823 |
| Heavy Atoms | 14 |
| Complexity | 229.0 |
Chemical Identifiers
| CAS Number | 3568-51-2 |
|---|---|
| SMILES | CCOP(=O)(OCCCl)OC=C(Cl)Cl |
| InChIKey | MXFVWCLDTWOWKM-UHFFFAOYSA-N |
Product Overview
2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate (CAS 3568-51-2), with molecular formula C6H10Cl3O4P and molecular weight 281.94 g/mol. IUPAC: 2-chloroethyl 2,2-dichloroethenyl ethyl phosphate.
Chemical Property Profile of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate
Property Insights of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate. With a topological polar surface area (TPSA) of 44.8 Ų, 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate has 0 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-Chloroethyl 2,2-dichloroethenyl ethyl phosphate?
The CAS number of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate is 3568-51-2.
What is the molecular formula of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate?
The molecular formula of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate is C6H10Cl3O4P.
What is the molecular weight of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate?
The molecular weight of 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate is 281.94 g/mol.
Where can I buy 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate?
You can request a quote for 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloroethyl 2,2-dichloroethenyl ethyl phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.