Methyl 2-(triphenylphosphoranyl)propanoate
TL;DR: Methyl 2-(triphenylphosphoranyl)propanoate (CAS 2689-62-5) is a chemical compound with molecular formula C22H22O2P+ and molecular weight 349.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-methoxy-1-oxopropan-2-yl)-triphenylphosphanium
Also Known As: Methyl 2-(triphenylphosphoranyl)propanoate, Methyl2- propanoate, (1-methoxy-1-oxopropan-2-yl)-triphenylphosphanium, (1-Methoxycarbonylethyl)triphenylphosphonium, [1-(Methoxycarbonyl)ethyl]triphenylphosphonium
| Molecular Formula | C22H22O2P+ |
|---|---|
| Molecular Weight | 349.14 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 349.13574 |
| Heavy Atoms | 25 |
| Complexity | 372.0 |
Chemical Identifiers
| CAS Number | 2689-62-5 |
|---|---|
| SMILES | CC(C(=O)OC)[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3 |
| InChIKey | MEWCABWAYWMDNW-UHFFFAOYSA-N |
Product Overview
Methyl 2-(triphenylphosphoranyl)propanoate (CAS 2689-62-5), with molecular formula C22H22O2P+ and molecular weight 349.14 g/mol. IUPAC: (1-methoxy-1-oxopropan-2-yl)-triphenylphosphanium.
Chemical Property Profile of Methyl 2-(triphenylphosphoranyl)propanoate
Property Insights of Methyl 2-(triphenylphosphoranyl)propanoate
The XLogP value of 4.9 indicates that Methyl 2-(triphenylphosphoranyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Methyl 2-(triphenylphosphoranyl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-(triphenylphosphoranyl)propanoate has 0 hydrogen bond donor(s) and 2 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 Methyl 2-(triphenylphosphoranyl)propanoate?
The CAS number of Methyl 2-(triphenylphosphoranyl)propanoate is 2689-62-5.
What is the molecular formula of Methyl 2-(triphenylphosphoranyl)propanoate?
The molecular formula of Methyl 2-(triphenylphosphoranyl)propanoate is C22H22O2P+.
What is the molecular weight of Methyl 2-(triphenylphosphoranyl)propanoate?
The molecular weight of Methyl 2-(triphenylphosphoranyl)propanoate is 349.14 g/mol.
Where can I buy Methyl 2-(triphenylphosphoranyl)propanoate?
You can request a quote for Methyl 2-(triphenylphosphoranyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-(triphenylphosphoranyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-(triphenylphosphoranyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.