Rpr 2
TL;DR: Rpr 2 (CAS 57113-18-5) is a chemical compound with molecular formula C9H17O5PS and molecular weight 268.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (E)-3-diethoxyphosphinothioyloxybut-2-enoate
Also Known As: Rpr-II, Rpr II, Dichlorovinyl acid, RPR 2, 2-Butenoic acid 3-(diethoxyphosphinothioyl)methyl ester
| Molecular Formula | C9H17O5PS |
|---|---|
| Molecular Weight | 268.05 g/mol |
| LogP | 2.3773 |
| Topological Polar Surface Area | 53.99 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 268.05344 |
| Heavy Atoms | 16 |
| Complexity | 292.27448 |
Chemical Identifiers
| CAS Number | 57113-18-5 |
|---|---|
| SMILES | CCOP(=S)(OCC)O/C(=C/C(=O)OC)/C |
Product Overview
Rpr 2 (CAS 57113-18-5), with molecular formula C9H17O5PS and molecular weight 268.05 g/mol. IUPAC: methyl (E)-3-diethoxyphosphinothioyloxybut-2-enoate.
Chemical Property Profile of Rpr 2
Property Insights of Rpr 2
The XLogP value of 2.3773 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Rpr 2. With a topological polar surface area (TPSA) of 53.99 Ų, Rpr 2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Rpr 2 has 0 hydrogen bond donor(s) and 6 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 Rpr 2?
The CAS number of Rpr 2 is 57113-18-5.
What is the molecular formula of Rpr 2?
The molecular formula of Rpr 2 is C9H17O5PS.
What is the molecular weight of Rpr 2?
The molecular weight of Rpr 2 is 268.05 g/mol.
Where can I buy Rpr 2?
You can request a quote for Rpr 2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Rpr 2?
Yes, KEHONG BIO provides custom synthesis services for Rpr 2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.