邻烯丙基甲苯醚
TL;DR: 邻烯丙基甲苯醚 (CAS 936626-74-3) is a chemical compound with molecular formula CC1=CC=CC=C1OCC=C and molecular weight 148.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻烯丙基甲苯醚
1-methyl-2-prop-2-enoxybenzene
Also Known As: Allyl o-tolyl ether, o-Allyloxytoluene, 2-Allyloxytoluene, ALLYLO-TOLYLETHER, Allyl o-Tolyl Ether ,
| Molecular Formula | CC1=CC=CC=C1OCC=C |
|---|---|
| Molecular Weight | 148.09 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 148.08882 |
| Heavy Atoms | 11 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 936626-74-3 |
|---|---|
| SMILES | CC1=CC=CC=C1OCC=C |
| InChIKey | LQOGVESOGIHDSO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
邻烯丙基甲苯醚 (CAS 936626-74-3), with molecular formula CC1=CC=CC=C1OCC=C and molecular weight 148.09 g/mol. IUPAC: 1-methyl-2-prop-2-enoxybenzene.
Chemical Property Profile of 邻烯丙基甲苯醚
Property Insights of 邻烯丙基甲苯醚
The XLogP value of 3.0 indicates that 邻烯丙基甲苯醚 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 邻烯丙基甲苯醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 邻烯丙基甲苯醚 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 邻烯丙基甲苯醚?
The CAS number of 邻烯丙基甲苯醚 is 936626-74-3.
What is the molecular formula of 邻烯丙基甲苯醚?
The molecular formula of 邻烯丙基甲苯醚 is CC1=CC=CC=C1OCC=C.
What is the molecular weight of 邻烯丙基甲苯醚?
The molecular weight of 邻烯丙基甲苯醚 is 148.09 g/mol.
Where can I buy 邻烯丙基甲苯醚?
You can request a quote for 邻烯丙基甲苯醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻烯丙基甲苯醚?
Yes, KEHONG BIO provides custom synthesis services for 邻烯丙基甲苯醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.