2-Methyl-3-buten-2-ol
TL;DR: 2-Methyl-3-buten-2-ol (CAS 115-18-4) is a chemical compound with molecular formula C5H10O and molecular weight 86.073166 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methylbut-3-en-2-ol
Also Known As: 2-METHYL-3-BUTEN-2-OL, 2-Methylbut-3-en-2-ol, Methylbutenol, isoprenyl alcohol, Dimethylvinylcarbinol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H10O |
| Molecular Weight | 86.073166 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 86.073166 Da |
| Heavy Atoms | 6 |
| Complexity | 55.0 |
| Melting Point | -28 °C |
| Boiling Point | 208.4 to 210.2 °F at 760 mmHg (USCG, 1999) |
| Density | 0.824 (USCG, 1999) - Less dense than water; will float |
| Flash Point | 56 °F (USCG, 1999) |
| Vapor Pressure | 23.5 [mmHg] |
| Solubility | 1000 mg/mL |
| SMILES | CC(C)(C=C)O |
| InChIKey | HNVRRHSXBLFLIG-UHFFFAOYSA-N |
Product Description
Applications: 2-Methyl-3-buten-2-ol is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Methyl-3-buten-2-ol (CAS 115-18-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A pharmaceutical intermediate supplied by CoreyChem, 2-Methyl-3-buten-2-ol (CAS 115-18-4) has the molecular formula C5H10O and a molecular weight of 86.07 g/mol. Reported properties include a density of 0.824 (USCG, 1999) - Less dense than water; will float g/cm³, a solubility: 1000 mg/mL. It is also known as 2-METHYL-3-BUTEN-2-OL and 2-Methylbut-3-en-2-ol.
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 2-Methyl-3-buten-2-ol
Property Insights of 2-Methyl-3-buten-2-ol
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-3-buten-2-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Methyl-3-buten-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-3-buten-2-ol has 1 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 2-Methyl-3-buten-2-ol?
The CAS number of 2-Methyl-3-buten-2-ol is 115-18-4.
What is the molecular formula of 2-Methyl-3-buten-2-ol?
The molecular formula of 2-Methyl-3-buten-2-ol is C5H10O.
What is the molecular weight of 2-Methyl-3-buten-2-ol?
The molecular weight of 2-Methyl-3-buten-2-ol is 86.073166 g/mol.
What are the applications of 2-Methyl-3-buten-2-ol?
2-Methyl-3-buten-2-ol is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Methyl-3-buten-2-ol (CAS 115-18-4) with custom...
Where can I buy 2-Methyl-3-buten-2-ol?
You can request a quote for 2-Methyl-3-buten-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-3-buten-2-ol?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-3-buten-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.