甲基叔戊基醚
TL;DR: 甲基叔戊基醚 (CAS 994-05-8) is a chemical compound with molecular formula C6H14O and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
甲基叔戊基醚
2-methoxy-2-methylbutane
Also Known As: tert-Amyl methyl ether, 2-Methoxy-2-methylbutane, Tame, Methyl tert-pentyl ether, tert-Pentyl methyl ether
| Molecular Formula | C6H14O |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 48.0 |
| Melting Point | -80 °C |
| Boiling Point | 86.3 °C |
| Density | 0.7660 g/cu cm at 25 °C |
| Solubility | Very soluble ethyl ether, ethanol |
| Flash Point | -7 °C (-7.2 °C) - closed cup |
| Vapor Pressure | 75.2 [mmHg] |
| Refractive Index | = 1.3862 at 25 °C |
Chemical Identifiers
| CAS Number | 994-05-8 |
|---|---|
| SMILES | CCC(C)(C)OC |
| InChIKey | HVZJRWJGKQPSFL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
甲基叔戊基醚 (CAS 994-05-8), with molecular formula C6H14O and molecular weight 102.10 g/mol. IUPAC: 2-methoxy-2-methylbutane.
Chemical Property Profile of 甲基叔戊基醚
Property Insights of 甲基叔戊基醚
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 甲基叔戊基醚. With a topological polar surface area (TPSA) of 9.2 Ų, 甲基叔戊基醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 甲基叔戊基醚 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 甲基叔戊基醚?
The CAS number of 甲基叔戊基醚 is 994-05-8.
What is the molecular formula of 甲基叔戊基醚?
The molecular formula of 甲基叔戊基醚 is C6H14O.
What is the molecular weight of 甲基叔戊基醚?
The molecular weight of 甲基叔戊基醚 is 102.10 g/mol.
Where can I buy 甲基叔戊基醚?
You can request a quote for 甲基叔戊基醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 甲基叔戊基醚?
Yes, KEHONG BIO provides custom synthesis services for 甲基叔戊基醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.