3-Methyl-3-buten-2-ol
TL;DR: 3-Methyl-3-buten-2-ol (CAS 10473-14-0) 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.
3-methylbut-3-en-2-ol
Also Known As: 3-Methyl-3-buten-2-ol, 3-methylbut-3-en-2-ol, 3-Buten-2-ol, 3-methyl-, 2-methyl-1-buten-3-ol, Methyl isopropenyl carbinol
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C5H10O |
| Molecular Weight | 86.073166 g/mol |
| XLogP | 1.2 |
| 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 | 57.0 |
| SMILES | CC(C(=C)C)O |
| InChIKey | JEYLKNVLTAPJAF-UHFFFAOYSA-N |
Chemical Property Profile of 3-Methyl-3-buten-2-ol
Property Insights of 3-Methyl-3-buten-2-ol
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-3-buten-2-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 3-Methyl-3-buten-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-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 3-Methyl-3-buten-2-ol?
The CAS number of 3-Methyl-3-buten-2-ol is 10473-14-0.
What is the molecular formula of 3-Methyl-3-buten-2-ol?
The molecular formula of 3-Methyl-3-buten-2-ol is C5H10O.
What is the molecular weight of 3-Methyl-3-buten-2-ol?
The molecular weight of 3-Methyl-3-buten-2-ol is 86.073166 g/mol.
Where can I buy 3-Methyl-3-buten-2-ol?
You can request a quote for 3-Methyl-3-buten-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Methyl-3-buten-2-ol?
Yes, CoreyChem provides custom synthesis services for 3-Methyl-3-buten-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.