3-(2-Methoxypropoxy)-1-butyne
TL;DR: 3-(2-Methoxypropoxy)-1-butyne (CAS 5616-57-9) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-methoxypropoxy)but-1-yne
Also Known As: 3-(2-Methoxypropoxy)-1-butyne, 3- -1-butyne, 3-(2-methoxypropoxy)but-1-yne, 1-Butyne, 3-(2-methoxypropoxy)-, 3-(2-Methoxypropoxy)-1-butyne #
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 5616-57-9 |
|---|---|
| SMILES | CC(COC(C)C#C)OC |
| InChIKey | PAADLSPKMNKTRP-UHFFFAOYSA-N |
Product Overview
3-(2-Methoxypropoxy)-1-butyne (CAS 5616-57-9), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: 3-(2-methoxypropoxy)but-1-yne.
Chemical Property Profile of 3-(2-Methoxypropoxy)-1-butyne
Property Insights of 3-(2-Methoxypropoxy)-1-butyne
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Methoxypropoxy)-1-butyne. With a topological polar surface area (TPSA) of 18.5 Ų, 3-(2-Methoxypropoxy)-1-butyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Methoxypropoxy)-1-butyne has 0 hydrogen bond donor(s) and 2 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-(2-Methoxypropoxy)-1-butyne?
The CAS number of 3-(2-Methoxypropoxy)-1-butyne is 5616-57-9.
What is the molecular formula of 3-(2-Methoxypropoxy)-1-butyne?
The molecular formula of 3-(2-Methoxypropoxy)-1-butyne is C8H14O2.
What is the molecular weight of 3-(2-Methoxypropoxy)-1-butyne?
The molecular weight of 3-(2-Methoxypropoxy)-1-butyne is 142.10 g/mol.
Where can I buy 3-(2-Methoxypropoxy)-1-butyne?
You can request a quote for 3-(2-Methoxypropoxy)-1-butyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Methoxypropoxy)-1-butyne?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Methoxypropoxy)-1-butyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.