Phosphorodichloridic acid, hexyl ester
TL;DR: Phosphorodichloridic acid, hexyl ester (CAS 53121-39-4) is a chemical compound with molecular formula C6H13Cl2O2P and molecular weight 218.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-dichlorophosphoryloxyhexane
Also Known As: hexyl phosphorodichloridate, 1-dichlorophosphoryloxyhexane, Phosphorodichloridic acid, hexyl ester, hexyl phosphoro dichloridate, hexyl phosphoro-dichloridate
| Molecular Formula | C6H13Cl2O2P |
|---|---|
| Molecular Weight | 218.00 g/mol |
| LogP | 4.169 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 218.00302 |
| Heavy Atoms | 11 |
| Complexity | 134.54398 |
Chemical Identifiers
| CAS Number | 53121-39-4 |
|---|---|
| SMILES | CCCCCCOP(=O)(Cl)Cl |
Product Overview
Phosphorodichloridic acid, hexyl ester (CAS 53121-39-4), with molecular formula C6H13Cl2O2P and molecular weight 218.00 g/mol. IUPAC: 1-dichlorophosphoryloxyhexane.
Chemical Property Profile of Phosphorodichloridic acid, hexyl ester
Property Insights of Phosphorodichloridic acid, hexyl ester
The XLogP value of 4.169 indicates that Phosphorodichloridic acid, hexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Phosphorodichloridic acid, hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorodichloridic acid, hexyl ester 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 Phosphorodichloridic acid, hexyl ester?
The CAS number of Phosphorodichloridic acid, hexyl ester is 53121-39-4.
What is the molecular formula of Phosphorodichloridic acid, hexyl ester?
The molecular formula of Phosphorodichloridic acid, hexyl ester is C6H13Cl2O2P.
What is the molecular weight of Phosphorodichloridic acid, hexyl ester?
The molecular weight of Phosphorodichloridic acid, hexyl ester is 218.00 g/mol.
Where can I buy Phosphorodichloridic acid, hexyl ester?
You can request a quote for Phosphorodichloridic acid, hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodichloridic acid, hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodichloridic acid, hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.