2-Butyne, 1,4-bis(ethylthio)-
TL;DR: 2-Butyne, 1,4-bis(ethylthio)- (CAS 13597-11-0) is a chemical compound with molecular formula C8H14S2 and molecular weight 174.0537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4-bis(ethylsulfanyl)but-2-yne
Also Known As: 2-Butyne, 1,4-bis(ethylthio)-, 1,4-Bis(ethylthio)-2-butyne, 1,4-bis(ethylsulfanyl)but-2-yne, 1,4-Diaethylthio-but-2-in, 1,4-bis(ethylthio)but-2-yne
Technical Specifications
| Molecular Formula | C8H14S2 |
| Molecular Weight | 174.0537 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 174.0537 Da |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
| SMILES | CCSCC#CCSCC |
| InChIKey | QHJHZAAOWXGVRD-UHFFFAOYSA-N |
Chemical Property Profile of 2-Butyne, 1,4-bis(ethylthio)-
Property Insights of 2-Butyne, 1,4-bis(ethylthio)-
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butyne, 1,4-bis(ethylthio)-. With a topological polar surface area (TPSA) of 50.6 Ų, 2-Butyne, 1,4-bis(ethylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butyne, 1,4-bis(ethylthio)- 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
What is the CAS number of 2-Butyne, 1,4-bis(ethylthio)-?
The CAS number of 2-Butyne, 1,4-bis(ethylthio)- is 13597-11-0.
What is the molecular formula of 2-Butyne, 1,4-bis(ethylthio)-?
The molecular formula of 2-Butyne, 1,4-bis(ethylthio)- is C8H14S2.
What is the molecular weight of 2-Butyne, 1,4-bis(ethylthio)-?
The molecular weight of 2-Butyne, 1,4-bis(ethylthio)- is 174.0537 g/mol.
Where can I buy 2-Butyne, 1,4-bis(ethylthio)-?
You can request a quote for 2-Butyne, 1,4-bis(ethylthio)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butyne, 1,4-bis(ethylthio)-?
Yes, CoreyChem provides custom synthesis services for 2-Butyne, 1,4-bis(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.