Butylphosphonic dichloride
TL;DR: Butylphosphonic dichloride (CAS 2302-80-9) is a chemical compound with molecular formula C4H9Cl2OP and molecular weight 173.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dichlorophosphorylbutane
Also Known As: Butylphosphonic dichloride, 1-dichlorophosphorylbutane, n-Butylphosphonic dichloride, 1-DODECANOL, n-Butylphosphonyl dichloride
| Molecular Formula | C4H9Cl2OP |
|---|---|
| Molecular Weight | 173.98 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 173.9768 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
Chemical Identifiers
| CAS Number | 2302-80-9 |
|---|---|
| SMILES | CCCCP(=O)(Cl)Cl |
| InChIKey | YITVQRWHXAYYIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butylphosphonic dichloride (CAS 2302-80-9), with molecular formula C4H9Cl2OP and molecular weight 173.98 g/mol. IUPAC: 1-dichlorophosphorylbutane.
Chemical Property Profile of Butylphosphonic dichloride
Property Insights of Butylphosphonic dichloride
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butylphosphonic dichloride. With a topological polar surface area (TPSA) of 17.1 Ų, Butylphosphonic dichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butylphosphonic 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 Butylphosphonic dichloride?
The CAS number of Butylphosphonic dichloride is 2302-80-9.
What is the molecular formula of Butylphosphonic dichloride?
The molecular formula of Butylphosphonic dichloride is C4H9Cl2OP.
What is the molecular weight of Butylphosphonic dichloride?
The molecular weight of Butylphosphonic dichloride is 173.98 g/mol.
Where can I buy Butylphosphonic dichloride?
You can request a quote for Butylphosphonic dichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butylphosphonic dichloride?
Yes, KEHONG BIO provides custom synthesis services for Butylphosphonic dichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.