2-Ethylbutyl dihydrogen phosphate
TL;DR: 2-Ethylbutyl dihydrogen phosphate (CAS 6965-19-1) is a chemical compound with molecular formula C6H15O4P and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylbutyl dihydrogen phosphate
Also Known As: 2-ethylbutyl dihydrogen phosphate, 1-Butanol,2-ethyl-, dihydrogen phosphate (8CI)
| Molecular Formula | C6H15O4P |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 182.0708 |
| Heavy Atoms | 11 |
| Complexity | 138.0 |
Chemical Identifiers
| CAS Number | 6965-19-1 |
|---|---|
| SMILES | CCC(CC)COP(=O)(O)O |
| InChIKey | WPNUQLDHLOBXJW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Ethylbutyl dihydrogen phosphate (CAS 6965-19-1), with molecular formula C6H15O4P and molecular weight 182.07 g/mol. IUPAC: 2-ethylbutyl dihydrogen phosphate.
Chemical Property Profile of 2-Ethylbutyl dihydrogen phosphate
Property Insights of 2-Ethylbutyl dihydrogen phosphate
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Ethylbutyl dihydrogen phosphate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Ethylbutyl dihydrogen phosphate. Following Lipinski's Rule of Five, 2-Ethylbutyl dihydrogen phosphate has 2 hydrogen bond donor(s) and 4 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-Ethylbutyl dihydrogen phosphate?
The CAS number of 2-Ethylbutyl dihydrogen phosphate is 6965-19-1.
What is the molecular formula of 2-Ethylbutyl dihydrogen phosphate?
The molecular formula of 2-Ethylbutyl dihydrogen phosphate is C6H15O4P.
What is the molecular weight of 2-Ethylbutyl dihydrogen phosphate?
The molecular weight of 2-Ethylbutyl dihydrogen phosphate is 182.07 g/mol.
Where can I buy 2-Ethylbutyl dihydrogen phosphate?
You can request a quote for 2-Ethylbutyl dihydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Ethylbutyl dihydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for 2-Ethylbutyl dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.