p-Tolyl ethyl carbonate
TL;DR: p-Tolyl ethyl carbonate (CAS 22719-81-9) is a chemical compound with molecular formula C10H12O3 and molecular weight 180.07864 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl (4-methylphenyl) carbonate
Also Known As: Ethyl p-tolyl carbonate, p-Tolyl ethyl carbonate, Ethyl p-cresyl carbonate, Ethyl 4-methylphenyl carbonate, Carbonic acid, ethyl p-tolyl ester
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12O3 |
| Molecular Weight | 180.07864 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.07864 Da |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
| SMILES | CCOC(=O)OC1=CC=C(C=C1)C |
| InChIKey | SMZZUTOGLVAUKB-UHFFFAOYSA-N |
Chemical Property Profile of p-Tolyl ethyl carbonate
Property Insights of p-Tolyl ethyl carbonate
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for p-Tolyl ethyl carbonate. With a topological polar surface area (TPSA) of 35.5 Ų, p-Tolyl ethyl carbonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-Tolyl ethyl carbonate has 0 hydrogen bond donor(s) and 3 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-Tolyl ethyl carbonate?
The CAS number of p-Tolyl ethyl carbonate is 22719-81-9.
What is the molecular formula of p-Tolyl ethyl carbonate?
The molecular formula of p-Tolyl ethyl carbonate is C10H12O3.
What is the molecular weight of p-Tolyl ethyl carbonate?
The molecular weight of p-Tolyl ethyl carbonate is 180.07864 g/mol.
Where can I buy p-Tolyl ethyl carbonate?
You can request a quote for p-Tolyl ethyl carbonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-Tolyl ethyl carbonate?
Yes, CoreyChem provides custom synthesis services for p-Tolyl ethyl carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.