丙烯酸甲酯
TL;DR: 丙烯酸甲酯 (CAS 96-33-3) is a chemical compound with molecular formula C4H6O2 and molecular weight 86.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
丙烯酸甲酯
methyl prop-2-enoate
Also Known As: METHYL ACRYLATE, Methylacrylate, Methyl prop-2-enoate, Acrylic acid methyl ester, Methyl propenoate
| Molecular Formula | C4H6O2 |
|---|---|
| Molecular Weight | 86.04 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.03678 |
| Heavy Atoms | 6 |
| Complexity | 65.0 |
| Melting Point | -76.5 °C |
| Boiling Point | 80.5 °C at 760 mmHg |
| Density | 0.956 at 20.0 °C - Less dense than water; will float |
| Solubility | 10 to 50 mg/mL at 72 °F (NTP, 1992) |
| Flash Point | 6.7 °C |
| Vapor Pressure | 40 mmHg at 9.2 °C ; 760 mmHg at 80.2 °C |
| Refractive Index | 1.4040 at 20 °C |
Chemical Identifiers
| CAS Number | 96-33-3 |
|---|---|
| SMILES | COC(=O)C=C |
| InChIKey | BAPJBEWLBFYGME-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
丙烯酸甲酯 (CAS 96-33-3), with molecular formula C4H6O2 and molecular weight 86.04 g/mol. IUPAC: methyl prop-2-enoate.
Chemical Property Profile of 丙烯酸甲酯
Property Insights of 丙烯酸甲酯
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 丙烯酸甲酯. With a topological polar surface area (TPSA) of 26.3 Ų, 丙烯酸甲酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 丙烯酸甲酯 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 丙烯酸甲酯?
The CAS number of 丙烯酸甲酯 is 96-33-3.
What is the molecular formula of 丙烯酸甲酯?
The molecular formula of 丙烯酸甲酯 is C4H6O2.
What is the molecular weight of 丙烯酸甲酯?
The molecular weight of 丙烯酸甲酯 is 86.04 g/mol.
Where can I buy 丙烯酸甲酯?
You can request a quote for 丙烯酸甲酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 丙烯酸甲酯?
Yes, KEHONG BIO provides custom synthesis services for 丙烯酸甲酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.