Methallyl propyl ether
TL;DR: Methallyl propyl ether (CAS 53897-29-3) is a chemical compound with molecular formula C7H14O and molecular weight 114.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-propoxyprop-1-ene
Also Known As: Methallyl propyl ether, Methallylpropyl ether, 2-methyl-3-propoxyprop-1-ene, 1-Propene, 2-methyl-3-propoxy-, 2-Methyl-3-propyloxy-1-propene
| Molecular Formula | C7H14O |
|---|---|
| Molecular Weight | 114.10 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 114.10446 |
| Heavy Atoms | 8 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 53897-29-3 |
|---|---|
| SMILES | CCCOCC(=C)C |
| InChIKey | WZZGWPLYYJIOLW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methallyl propyl ether (CAS 53897-29-3), with molecular formula C7H14O and molecular weight 114.10 g/mol. IUPAC: 2-methyl-3-propoxyprop-1-ene.
Chemical Property Profile of Methallyl propyl ether
Property Insights of Methallyl propyl ether
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methallyl propyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, Methallyl propyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methallyl propyl ether 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 Methallyl propyl ether?
The CAS number of Methallyl propyl ether is 53897-29-3.
What is the molecular formula of Methallyl propyl ether?
The molecular formula of Methallyl propyl ether is C7H14O.
What is the molecular weight of Methallyl propyl ether?
The molecular weight of Methallyl propyl ether is 114.10 g/mol.
Where can I buy Methallyl propyl ether?
You can request a quote for Methallyl propyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methallyl propyl ether?
Yes, KEHONG BIO provides custom synthesis services for Methallyl propyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.