4-tert-Pentylphenyl dihydrogen phosphate
TL;DR: 4-tert-Pentylphenyl dihydrogen phosphate (CAS 200725-69-5) is a chemical compound with molecular formula C11H17O4P and molecular weight 244.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(2-methylbutan-2-yl)phenyl] dihydrogen phosphate
Also Known As: 4-tert-Pentylphenyl dihydrogenphosphate, 4-(tert-pentyl)phenyl phosphate, 4-tert-Pentylphenyl dihydrogen phosphate, Phenol, 4-(1,1-dimethylpropyl)-, dihydrogen phosphate, [4-(2-methylbutan-2-yl)phenoxy]phosphonic Acid
| Molecular Formula | C11H17O4P |
|---|---|
| Molecular Weight | 244.09 g/mol |
| LogP | 2.8457 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 244.08644 |
| Heavy Atoms | 16 |
| Complexity | 390.95053 |
Chemical Identifiers
| CAS Number | 200725-69-5 |
|---|---|
| SMILES | CCC(C)(C)C1=CC=C(C=C1)OP(=O)(O)O |
Product Overview
4-tert-Pentylphenyl dihydrogen phosphate (CAS 200725-69-5), with molecular formula C11H17O4P and molecular weight 244.09 g/mol. IUPAC: [4-(2-methylbutan-2-yl)phenyl] dihydrogen phosphate.
Chemical Property Profile of 4-tert-Pentylphenyl dihydrogen phosphate
Property Insights of 4-tert-Pentylphenyl dihydrogen phosphate
The XLogP value of 2.8457 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-tert-Pentylphenyl dihydrogen phosphate. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-tert-Pentylphenyl dihydrogen phosphate. Following Lipinski's Rule of Five, 4-tert-Pentylphenyl dihydrogen phosphate has 2 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 4-tert-Pentylphenyl dihydrogen phosphate?
The CAS number of 4-tert-Pentylphenyl dihydrogen phosphate is 200725-69-5.
What is the molecular formula of 4-tert-Pentylphenyl dihydrogen phosphate?
The molecular formula of 4-tert-Pentylphenyl dihydrogen phosphate is C11H17O4P.
What is the molecular weight of 4-tert-Pentylphenyl dihydrogen phosphate?
The molecular weight of 4-tert-Pentylphenyl dihydrogen phosphate is 244.09 g/mol.
Where can I buy 4-tert-Pentylphenyl dihydrogen phosphate?
You can request a quote for 4-tert-Pentylphenyl dihydrogen phosphate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-tert-Pentylphenyl dihydrogen phosphate?
Yes, KEHONG BIO provides custom synthesis services for 4-tert-Pentylphenyl dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.