p-tert-Butylphenyl dihydrogen phosphate
TL;DR: p-tert-Butylphenyl dihydrogen phosphate (CAS 13421-39-1) is a chemical compound with molecular formula C10H15O4P and molecular weight 230.0708 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-tert-butylphenyl) dihydrogen phosphate
Also Known As: p-tert-Butylphenyl dihydrogen phosphate, 4-t-butylphenylphosphoric acid, (4-tert-butylphenyl) dihydrogen phosphate, p-tert-Butylphenyldihydrogenphosphate, (4-tert-butylphenoxy)phosphonic acid
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H15O4P |
| Molecular Weight | 230.0708 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 66.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 230.0708 Da |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)OP(=O)(O)O |
| InChIKey | BFVWABPNHXPWPS-UHFFFAOYSA-N |
Chemical Property Profile of p-tert-Butylphenyl dihydrogen phosphate
Property Insights of p-tert-Butylphenyl dihydrogen phosphate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-tert-Butylphenyl dihydrogen phosphate. The TPSA of 66.8 Ų falls within the moderate polarity range, balancing permeability and solubility for p-tert-Butylphenyl dihydrogen phosphate. Following Lipinski's Rule of Five, p-tert-Butylphenyl 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
What is the CAS number of p-tert-Butylphenyl dihydrogen phosphate?
The CAS number of p-tert-Butylphenyl dihydrogen phosphate is 13421-39-1.
What is the molecular formula of p-tert-Butylphenyl dihydrogen phosphate?
The molecular formula of p-tert-Butylphenyl dihydrogen phosphate is C10H15O4P.
What is the molecular weight of p-tert-Butylphenyl dihydrogen phosphate?
The molecular weight of p-tert-Butylphenyl dihydrogen phosphate is 230.0708 g/mol.
Where can I buy p-tert-Butylphenyl dihydrogen phosphate?
You can request a quote for p-tert-Butylphenyl dihydrogen phosphate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-tert-Butylphenyl dihydrogen phosphate?
Yes, CoreyChem provides custom synthesis services for p-tert-Butylphenyl dihydrogen phosphate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.