3,5-Ditert-butyl-5-hydroxyfuran-2-one
TL;DR: 3,5-Ditert-butyl-5-hydroxyfuran-2-one (CAS 3807-35-0) is a chemical compound with molecular formula C12H20O3 and molecular weight 212.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-ditert-butyl-5-hydroxyfuran-2-one
Also Known As: 3,5-ditert-butyl-5-hydroxyfuran-2-one, 3,5-ditert-butyl-5-hydroxy-2(5H)-furanone, 5-hydroxy-3,5-di-tert-butyl-2-furanone, J2.542.674F, 5-Hydroxy-3,5-di-tert-butylfuran-2(5H)-one
| Molecular Formula | C12H20O3 |
|---|---|
| Molecular Weight | 212.14 g/mol |
| LogP | 2.2504 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 212.14125 |
| Heavy Atoms | 15 |
| Complexity | 314.73938 |
Chemical Identifiers
| CAS Number | 3807-35-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC(OC1=O)(C(C)(C)C)O |
Product Overview
3,5-Ditert-butyl-5-hydroxyfuran-2-one (CAS 3807-35-0), with molecular formula C12H20O3 and molecular weight 212.14 g/mol. IUPAC: 3,5-ditert-butyl-5-hydroxyfuran-2-one.
Chemical Property Profile of 3,5-Ditert-butyl-5-hydroxyfuran-2-one
Property Insights of 3,5-Ditert-butyl-5-hydroxyfuran-2-one
The XLogP value of 2.2504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,5-Ditert-butyl-5-hydroxyfuran-2-one. With a topological polar surface area (TPSA) of 46.53 Ų, 3,5-Ditert-butyl-5-hydroxyfuran-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Ditert-butyl-5-hydroxyfuran-2-one has 1 hydrogen bond donor(s) and 3 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 3,5-Ditert-butyl-5-hydroxyfuran-2-one?
The CAS number of 3,5-Ditert-butyl-5-hydroxyfuran-2-one is 3807-35-0.
What is the molecular formula of 3,5-Ditert-butyl-5-hydroxyfuran-2-one?
The molecular formula of 3,5-Ditert-butyl-5-hydroxyfuran-2-one is C12H20O3.
What is the molecular weight of 3,5-Ditert-butyl-5-hydroxyfuran-2-one?
The molecular weight of 3,5-Ditert-butyl-5-hydroxyfuran-2-one is 212.14 g/mol.
Where can I buy 3,5-Ditert-butyl-5-hydroxyfuran-2-one?
You can request a quote for 3,5-Ditert-butyl-5-hydroxyfuran-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Ditert-butyl-5-hydroxyfuran-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Ditert-butyl-5-hydroxyfuran-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.