tert-Butyl 1-methyl-2-propynyl ether
TL;DR: tert-Butyl 1-methyl-2-propynyl ether (CAS 26826-40-4) is a chemical compound with molecular formula C8H14O and molecular weight 126.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(2-methylpropan-2-yl)oxy]but-1-yne
Also Known As: tBMP ether, 3-(tert-butoxy)but-1-yne, 3-tert-butoxy-1-butyne, tert-butyl 1-methyl-2-propynyl ether, 3-tert-butoxybut-1-yne
| Molecular Formula | C8H14O |
|---|---|
| Molecular Weight | 126.10 g/mol |
| LogP | 1.8232 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 126.10446 |
| Heavy Atoms | 9 |
| Complexity | 113.50977 |
Chemical Identifiers
| CAS Number | 26826-40-4 |
|---|---|
| SMILES | CC(C#C)OC(C)(C)C |
Product Overview
tert-Butyl 1-methyl-2-propynyl ether (CAS 26826-40-4), with molecular formula C8H14O and molecular weight 126.10 g/mol. IUPAC: 3-[(2-methylpropan-2-yl)oxy]but-1-yne.
Chemical Property Profile of tert-Butyl 1-methyl-2-propynyl ether
Property Insights of tert-Butyl 1-methyl-2-propynyl ether
The XLogP value of 1.8232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl 1-methyl-2-propynyl ether. With a topological polar surface area (TPSA) of 9.23 Ų, tert-Butyl 1-methyl-2-propynyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, tert-Butyl 1-methyl-2-propynyl ether 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 tert-Butyl 1-methyl-2-propynyl ether?
The CAS number of tert-Butyl 1-methyl-2-propynyl ether is 26826-40-4.
What is the molecular formula of tert-Butyl 1-methyl-2-propynyl ether?
The molecular formula of tert-Butyl 1-methyl-2-propynyl ether is C8H14O.
What is the molecular weight of tert-Butyl 1-methyl-2-propynyl ether?
The molecular weight of tert-Butyl 1-methyl-2-propynyl ether is 126.10 g/mol.
Where can I buy tert-Butyl 1-methyl-2-propynyl ether?
You can request a quote for tert-Butyl 1-methyl-2-propynyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for tert-Butyl 1-methyl-2-propynyl ether?
Yes, KEHONG BIO provides custom synthesis services for tert-Butyl 1-methyl-2-propynyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.