Methyl vinyl ketone
TL;DR: Methyl vinyl ketone (CAS 78-94-4) is a chemical compound with molecular formula C4H6O and molecular weight 70.04186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-3-en-2-one
Also Known As: METHYL VINYL KETONE, 3-Buten-2-one, Butenone, but-3-en-2-one, Methylvinylketon
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H6O |
| Molecular Weight | 70.04186 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 70.04186 Da |
| Heavy Atoms | 5 |
| Complexity | 54.0 |
| Melting Point | 20 °F (EPA, 1998) |
| Boiling Point | 179 °F at 760 mmHg (EPA, 1998) |
| Density | 0.8407 to 0.8636 at 68 to 77 °F (EPA, 1998) |
| Flash Point | 20 °F (EPA, 1998) |
| Vapor Pressure | 86 mmHg at 72 °F ; 276 mmHg at 124 °F; 661 mmHg at 167 °F (NTP, 1992) |
| Refractive Index | Index of refraction: 1.4086 at 20 °C/D |
| Solubility | greater than or equal to 100 mg/mL at 72 °F (NTP, 1992) |
| SMILES | CC(=O)C=C |
| InChIKey | FUSUHKVFWTUUBE-UHFFFAOYSA-N |
Product Description
Applications: Methyl vinyl ketone is used in polymer chemistry and functional materials synthesis, as well as imaging, photographic, and photosensitive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Methyl vinyl ketone (CAS 78-94-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Methyl vinyl ketone (CAS 78-94-4) is a polymer intermediate with the molecular formula C4H6O and a molecular weight of 70.04 g/mol. Key physical properties include a density of 0.8407 to 0.8636 at 68 to 77 °F (EPA, 1998) g/cm³, a solubility: greater than or equal to 100 mg/mL at 72 °F (NTP, 1992). It is also known as METHYL VINYL KETONE and 3-Buten-2-one.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Methyl vinyl ketone
Property Insights of Methyl vinyl ketone
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl vinyl ketone. With a topological polar surface area (TPSA) of 17.1 Ų, Methyl vinyl ketone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl vinyl ketone 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
What is the CAS number of Methyl vinyl ketone?
The CAS number of Methyl vinyl ketone is 78-94-4.
What is the molecular formula of Methyl vinyl ketone?
The molecular formula of Methyl vinyl ketone is C4H6O.
What is the molecular weight of Methyl vinyl ketone?
The molecular weight of Methyl vinyl ketone is 70.04186 g/mol.
What are the applications of Methyl vinyl ketone?
Methyl vinyl ketone is used in polymer chemistry and functional materials synthesis, as well as imaging, photographic, and photosensitive formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Methyl vinyl ketone (CAS 78-94-4) with custom...
Where can I buy Methyl vinyl ketone?
You can request a quote for Methyl vinyl ketone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Methyl vinyl ketone?
Yes, CoreyChem provides custom synthesis services for Methyl vinyl ketone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.