![[2-(Dimethylphosphoryl)ethynyl]benzene structure](/static/products/6457/64577-17-9.webp)
[2-(Dimethylphosphoryl)ethynyl]benzene
TL;DR: [2-(Dimethylphosphoryl)ethynyl]benzene (CAS 64577-17-9) is a chemical compound with molecular formula C10H11OP and molecular weight 178.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dimethylphosphorylethynylbenzene
Also Known As: 2-dimethylphosphorylethynylbenzene, [2-(dimethylphosphoryl)ethynyl]benzene
| Molecular Formula | C10H11OP |
|---|---|
| Molecular Weight | 178.05 g/mol |
| LogP | 2.6183 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 178.05475 |
| Heavy Atoms | 12 |
| Complexity | 350.42014 |
Chemical Identifiers
| CAS Number | 64577-17-9 |
|---|---|
| SMILES | CP(=O)(C)C#CC1=CC=CC=C1 |
Product Overview
[2-(Dimethylphosphoryl)ethynyl]benzene (CAS 64577-17-9), with molecular formula C10H11OP and molecular weight 178.05 g/mol. IUPAC: 2-dimethylphosphorylethynylbenzene.
Chemical Property Profile of [2-(Dimethylphosphoryl)ethynyl]benzene
Property Insights of [2-(Dimethylphosphoryl)ethynyl]benzene
The XLogP value of 2.6183 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(Dimethylphosphoryl)ethynyl]benzene. With a topological polar surface area (TPSA) of 17.07 Ų, [2-(Dimethylphosphoryl)ethynyl]benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [2-(Dimethylphosphoryl)ethynyl]benzene has 0 hydrogen bond donor(s) and 1 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-(Dimethylphosphoryl)ethynyl]benzene?
The CAS number of [2-(Dimethylphosphoryl)ethynyl]benzene is 64577-17-9.
What is the molecular formula of [2-(Dimethylphosphoryl)ethynyl]benzene?
The molecular formula of [2-(Dimethylphosphoryl)ethynyl]benzene is C10H11OP.
What is the molecular weight of [2-(Dimethylphosphoryl)ethynyl]benzene?
The molecular weight of [2-(Dimethylphosphoryl)ethynyl]benzene is 178.05 g/mol.
Where can I buy [2-(Dimethylphosphoryl)ethynyl]benzene?
You can request a quote for [2-(Dimethylphosphoryl)ethynyl]benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(Dimethylphosphoryl)ethynyl]benzene?
Yes, KEHONG BIO provides custom synthesis services for [2-(Dimethylphosphoryl)ethynyl]benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.