Phosphoric acid, (1-methylethyl)phenyl phenyl ester
TL;DR: Phosphoric acid, (1-methylethyl)phenyl phenyl ester (CAS 68782-95-6) is a chemical compound with molecular formula C15H21O6P and molecular weight 328.10757 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
phenol;phosphoric acid;2-propan-2-ylphenol
Also Known As: Isopropylphenyl phenyl phosphate, phenol;phosphoric acid;2-propan-2-ylphenol, Phenol, isopropylated phenol, phosphorus oxychloride reaction product, Phosphoric acid, (1-methylethyl)phenyl phenyl ester, phenol; phosphoric acid; 2-propan-2-ylphenol
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H21O6P |
| Molecular Weight | 328.10757 g/mol |
| XLogP | 2.98 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 328.10757 Da |
| Heavy Atoms | 22 |
| Complexity | 195.0 |
| SMILES | CC(C)C1=CC=CC=C1O.C1=CC=C(C=C1)O.OP(=O)(O)O |
| InChIKey | BPBKRDYGSICSGE-UHFFFAOYSA-N |
Chemical Property Profile of Phosphoric acid, (1-methylethyl)phenyl phenyl ester
Property Insights of Phosphoric acid, (1-methylethyl)phenyl phenyl ester
The XLogP value of 2.98 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphoric acid, (1-methylethyl)phenyl phenyl ester. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphoric acid, (1-methylethyl)phenyl phenyl ester. Following Lipinski's Rule of Five, Phosphoric acid, (1-methylethyl)phenyl phenyl ester has 5 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phosphoric acid, (1-methylethyl)phenyl phenyl ester?
The CAS number of Phosphoric acid, (1-methylethyl)phenyl phenyl ester is 68782-95-6.
What is the molecular formula of Phosphoric acid, (1-methylethyl)phenyl phenyl ester?
The molecular formula of Phosphoric acid, (1-methylethyl)phenyl phenyl ester is C15H21O6P.
What is the molecular weight of Phosphoric acid, (1-methylethyl)phenyl phenyl ester?
The molecular weight of Phosphoric acid, (1-methylethyl)phenyl phenyl ester is 328.10757 g/mol.
Where can I buy Phosphoric acid, (1-methylethyl)phenyl phenyl ester?
You can request a quote for Phosphoric acid, (1-methylethyl)phenyl phenyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphoric acid, (1-methylethyl)phenyl phenyl ester?
Yes, CoreyChem provides custom synthesis services for Phosphoric acid, (1-methylethyl)phenyl phenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.