Allylphosphonic dichloride
TL;DR: Allylphosphonic dichloride (CAS 3944-27-2) is a chemical compound with molecular formula C=CCP(=O)(Cl)Cl and molecular weight 157.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-dichlorophosphorylprop-1-ene
Also Known As: Allylphosphonic dichloride, Allylphosphonicdichloride, 3-dichlorophosphorylprop-1-ene, Allyldichlorophosphine oxide, Allylphosphonic aciddichloride
| Molecular Formula | C=CCP(=O)(Cl)Cl |
|---|---|
| Molecular Weight | 157.95 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 157.94551 |
| Heavy Atoms | 7 |
| Complexity | 106.0 |
Chemical Identifiers
| CAS Number | 3944-27-2 |
|---|---|
| SMILES | C=CCP(=O)(Cl)Cl |
| InChIKey | LTHAMOYJECKDMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Allylphosphonic dichloride (CAS 3944-27-2), with molecular formula C=CCP(=O)(Cl)Cl and molecular weight 157.95 g/mol. IUPAC: 3-dichlorophosphorylprop-1-ene.
Chemical Property Profile of Allylphosphonic dichloride
Property Insights of Allylphosphonic dichloride
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Allylphosphonic dichloride. With a topological polar surface area (TPSA) of 17.1 Ų, Allylphosphonic dichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Allylphosphonic dichloride 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 Allylphosphonic dichloride?
The CAS number of Allylphosphonic dichloride is 3944-27-2.
What is the molecular formula of Allylphosphonic dichloride?
The molecular formula of Allylphosphonic dichloride is C=CCP(=O)(Cl)Cl.
What is the molecular weight of Allylphosphonic dichloride?
The molecular weight of Allylphosphonic dichloride is 157.95 g/mol.
Where can I buy Allylphosphonic dichloride?
You can request a quote for Allylphosphonic dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Allylphosphonic dichloride?
Yes, KEHONG BIO provides custom synthesis services for Allylphosphonic dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.