二间甲苯基醚
TL;DR: 二间甲苯基醚 (CAS 19814-71-2) is a chemical compound with molecular formula C14H14O and molecular weight 198.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二间甲苯基醚
1-methyl-3-(3-methylphenoxy)benzene
Also Known As: Di-m-tolyl ether, ditolylether, 1-Methyl-3-(3-methylphenoxy)benzene, m-Tolyl ester, TOLYL ETHER
| Molecular Formula | C14H14O |
|---|---|
| Molecular Weight | 198.10 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 198.10446 |
| Heavy Atoms | 15 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 19814-71-2 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OC2=CC=CC(=C2)C |
| InChIKey | FDLFMPKQBNPIER-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二间甲苯基醚 (CAS 19814-71-2), with molecular formula C14H14O and molecular weight 198.10 g/mol. IUPAC: 1-methyl-3-(3-methylphenoxy)benzene.
Chemical Property Profile of 二间甲苯基醚
Property Insights of 二间甲苯基醚
The XLogP value of 4.6 indicates that 二间甲苯基醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 二间甲苯基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 二间甲苯基醚 has 0 hydrogen bond donor(s) and 1 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 二间甲苯基醚?
The CAS number of 二间甲苯基醚 is 19814-71-2.
What is the molecular formula of 二间甲苯基醚?
The molecular formula of 二间甲苯基醚 is C14H14O.
What is the molecular weight of 二间甲苯基醚?
The molecular weight of 二间甲苯基醚 is 198.10 g/mol.
Where can I buy 二间甲苯基醚?
You can request a quote for 二间甲苯基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二间甲苯基醚?
Yes, KEHONG BIO provides custom synthesis services for 二间甲苯基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.