二(间甲苯基)碳酸酯
TL;DR: 二(间甲苯基)碳酸酯 (CAS 66891-06-3) is a chemical compound with molecular formula C15H14O3 and molecular weight 242.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二(间甲苯基)碳酸酯
bis(3-methylphenyl) carbonate
Also Known As: DI-M-TOLYL CARBONATE, bis(3-methylphenyl) carbonate, di(m-cresyl) carbonate, bis-m-tolyl carbonate, di-m-cresyl carbonate
| Molecular Formula | C15H14O3 |
|---|---|
| Molecular Weight | 242.09 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.0943 |
| Heavy Atoms | 18 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 66891-06-3 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OC(=O)OC2=CC=CC(=C2)C |
| InChIKey | PDYNXWPJDVOHDW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二(间甲苯基)碳酸酯 (CAS 66891-06-3), with molecular formula C15H14O3 and molecular weight 242.09 g/mol. IUPAC: bis(3-methylphenyl) carbonate.
Chemical Property Profile of 二(间甲苯基)碳酸酯
Property Insights of 二(间甲苯基)碳酸酯
The XLogP value of 4.4 indicates that 二(间甲苯基)碳酸酯 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, 二(间甲苯基)碳酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二(间甲苯基)碳酸酯 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
Frequently Asked Questions
What is the CAS number of 二(间甲苯基)碳酸酯?
The CAS number of 二(间甲苯基)碳酸酯 is 66891-06-3.
What is the molecular formula of 二(间甲苯基)碳酸酯?
The molecular formula of 二(间甲苯基)碳酸酯 is C15H14O3.
What is the molecular weight of 二(间甲苯基)碳酸酯?
The molecular weight of 二(间甲苯基)碳酸酯 is 242.09 g/mol.
Where can I buy 二(间甲苯基)碳酸酯?
You can request a quote for 二(间甲苯基)碳酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二(间甲苯基)碳酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二(间甲苯基)碳酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.