3,3-Dimethyltetrahydrofuran
TL;DR: 3,3-Dimethyltetrahydrofuran (CAS 15833-75-7) is a chemical compound with molecular formula C6H12O and molecular weight 100.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dimethyloxolane
Also Known As: 3,3-dimethyloxolane, 3,3-dimethyltetrahydrofuran, 4-dimethyltetrahydrofuran, 3,3-Dimethyl-tetrahydrofuran, 3,3-dimethyl-tetrahydro-furan
| Molecular Formula | C6H12O |
|---|---|
| Molecular Weight | 100.09 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 100.08881 |
| Heavy Atoms | 7 |
| Complexity | 66.0 |
Chemical Identifiers
| CAS Number | 15833-75-7 |
|---|---|
| SMILES | CC1(CCOC1)C |
| InChIKey | WDKUXUZYKCXAHC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,3-Dimethyltetrahydrofuran (CAS 15833-75-7), with molecular formula C6H12O and molecular weight 100.09 g/mol. IUPAC: 3,3-dimethyloxolane.
Chemical Property Profile of 3,3-Dimethyltetrahydrofuran
Property Insights of 3,3-Dimethyltetrahydrofuran
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3-Dimethyltetrahydrofuran. With a topological polar surface area (TPSA) of 9.2 Ų, 3,3-Dimethyltetrahydrofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,3-Dimethyltetrahydrofuran 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
Frequently Asked Questions
What is the CAS number of 3,3-Dimethyltetrahydrofuran?
The CAS number of 3,3-Dimethyltetrahydrofuran is 15833-75-7.
What is the molecular formula of 3,3-Dimethyltetrahydrofuran?
The molecular formula of 3,3-Dimethyltetrahydrofuran is C6H12O.
What is the molecular weight of 3,3-Dimethyltetrahydrofuran?
The molecular weight of 3,3-Dimethyltetrahydrofuran is 100.09 g/mol.
Where can I buy 3,3-Dimethyltetrahydrofuran?
You can request a quote for 3,3-Dimethyltetrahydrofuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3-Dimethyltetrahydrofuran?
Yes, KEHONG BIO provides custom synthesis services for 3,3-Dimethyltetrahydrofuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.