2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid
TL;DR: 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid (CAS 294653-46-6) is a chemical compound with molecular formula C7H12Cl2NO4P and molecular weight 274.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2,2-dichloro-1-(2,2-dimethylpropanoylamino)ethenyl]phosphonic acid
Also Known As: (2,2-dichloro-1-pivalamidovinyl)phosphonic acid, 2,2-dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid, [2,2-dichloro-1-(pivaloylamino)vinyl]phosphonic acid, Phosphonic acid, [2,2-dichloro-1-[(2,2-dimethyl-1-oxopropyl)amino]ethenyl]-, [2,2-dichloro-1-(2,2-dimethylpropanoylamino)ethenyl]phosphonic acid
| Molecular Formula | C7H12Cl2NO4P |
|---|---|
| Molecular Weight | 274.99 g/mol |
| LogP | 1.9306 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 274.9881 |
| Heavy Atoms | 15 |
| Complexity | 337.3896 |
Chemical Identifiers
| CAS Number | 294653-46-6 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC(=C(Cl)Cl)P(=O)(O)O |
Product Overview
2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid (CAS 294653-46-6), with molecular formula C7H12Cl2NO4P and molecular weight 274.99 g/mol. IUPAC: [2,2-dichloro-1-(2,2-dimethylpropanoylamino)ethenyl]phosphonic acid.
Chemical Property Profile of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid
Property Insights of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid
The XLogP value of 1.9306 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid. Following Lipinski's Rule of Five, 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid has 3 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 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid?
The CAS number of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid is 294653-46-6.
What is the molecular formula of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid?
The molecular formula of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid is C7H12Cl2NO4P.
What is the molecular weight of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid?
The molecular weight of 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid is 274.99 g/mol.
Where can I buy 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid?
You can request a quote for 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dichloro-1-[(2,2-dimethylpropanoyl)amino]vinylphosphonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.