Methallyl acrylate
TL;DR: Methallyl acrylate (CAS 818-67-7) is a chemical compound with molecular formula C7H10O2 and molecular weight 126.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylprop-2-enyl prop-2-enoate
Also Known As: METHALLYL ACRYLATE, Methallylacrylate, 2-methylprop-2-enyl prop-2-enoate, 2-methylallyl acrylate, 2-methylprop-2-en-1-yl prop-2-enoate
| Molecular Formula | C7H10O2 |
|---|---|
| Molecular Weight | 126.07 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 126.06808 |
| Heavy Atoms | 9 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 818-67-7 |
|---|---|
| SMILES | CC(=C)COC(=O)C=C |
| InChIKey | HVVPYFQMCGANJX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methallyl acrylate (CAS 818-67-7), with molecular formula C7H10O2 and molecular weight 126.07 g/mol. IUPAC: 2-methylprop-2-enyl prop-2-enoate.
Chemical Property Profile of Methallyl acrylate
Property Insights of Methallyl acrylate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methallyl acrylate. With a topological polar surface area (TPSA) of 26.3 Ų, Methallyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methallyl acrylate has 0 hydrogen bond donor(s) and 2 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 acrylate?
The CAS number of Methallyl acrylate is 818-67-7.
What is the molecular formula of Methallyl acrylate?
The molecular formula of Methallyl acrylate is C7H10O2.
What is the molecular weight of Methallyl acrylate?
The molecular weight of Methallyl acrylate is 126.07 g/mol.
Where can I buy Methallyl acrylate?
You can request a quote for Methallyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methallyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for Methallyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.