Pentane, 1,5-bis(ethylthio)-
TL;DR: Pentane, 1,5-bis(ethylthio)- (CAS 54815-22-4) is a chemical compound with molecular formula C9H20S2 and molecular weight 192.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-bis(ethylsulfanyl)pentane
Also Known As: 3,9-Dithiaundecane, Pentane, 1,5-bis(ethylthio)-, 1,5-bis(ethylthio)pentane, 1,5-Bis(ethylsulfanyl)pentane, 1,5-Bis(ethylsulfanyl)pentane #
| Molecular Formula | C9H20S2 |
|---|---|
| Molecular Weight | 192.10 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 192.10065 |
| Heavy Atoms | 11 |
| Complexity | 56.0 |
Chemical Identifiers
| CAS Number | 54815-22-4 |
|---|---|
| SMILES | CCSCCCCCSCC |
| InChIKey | OHQCQYMEDAANNT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pentane, 1,5-bis(ethylthio)- (CAS 54815-22-4), with molecular formula C9H20S2 and molecular weight 192.10 g/mol. IUPAC: 1,5-bis(ethylsulfanyl)pentane.
Chemical Property Profile of Pentane, 1,5-bis(ethylthio)-
Property Insights of Pentane, 1,5-bis(ethylthio)-
The XLogP value of 3.3 indicates that Pentane, 1,5-bis(ethylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Pentane, 1,5-bis(ethylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentane, 1,5-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
Frequently Asked Questions
What is the CAS number of Pentane, 1,5-bis(ethylthio)-?
The CAS number of Pentane, 1,5-bis(ethylthio)- is 54815-22-4.
What is the molecular formula of Pentane, 1,5-bis(ethylthio)-?
The molecular formula of Pentane, 1,5-bis(ethylthio)- is C9H20S2.
What is the molecular weight of Pentane, 1,5-bis(ethylthio)-?
The molecular weight of Pentane, 1,5-bis(ethylthio)- is 192.10 g/mol.
Where can I buy Pentane, 1,5-bis(ethylthio)-?
You can request a quote for Pentane, 1,5-bis(ethylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pentane, 1,5-bis(ethylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Pentane, 1,5-bis(ethylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.