Thiophene, 2-(pentylthio)-
TL;DR: Thiophene, 2-(pentylthio)- (CAS 54798-87-7) is a chemical compound with molecular formula C9H14S2 and molecular weight 186.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pentylsulfanylthiophene
Also Known As: Thiophene, 2-(pentylthio)-, 2-(Pentylthio)thiophene, 2- thiophene, 2-pentylsulfanylthiophene, 1-(2-Thienyl)-1-thiahexane
| Molecular Formula | C9H14S2 |
|---|---|
| Molecular Weight | 186.05 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 186.0537 |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 54798-87-7 |
|---|---|
| SMILES | CCCCCSC1=CC=CS1 |
| InChIKey | PMOLPBAEMHMCKW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Thiophene, 2-(pentylthio)- (CAS 54798-87-7), with molecular formula C9H14S2 and molecular weight 186.05 g/mol. IUPAC: 2-pentylsulfanylthiophene.
Chemical Property Profile of Thiophene, 2-(pentylthio)-
Property Insights of Thiophene, 2-(pentylthio)-
The XLogP value of 4.2 indicates that Thiophene, 2-(pentylthio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.5 Ų, Thiophene, 2-(pentylthio)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene, 2-(pentylthio)- 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 Thiophene, 2-(pentylthio)-?
The CAS number of Thiophene, 2-(pentylthio)- is 54798-87-7.
What is the molecular formula of Thiophene, 2-(pentylthio)-?
The molecular formula of Thiophene, 2-(pentylthio)- is C9H14S2.
What is the molecular weight of Thiophene, 2-(pentylthio)-?
The molecular weight of Thiophene, 2-(pentylthio)- is 186.05 g/mol.
Where can I buy Thiophene, 2-(pentylthio)-?
You can request a quote for Thiophene, 2-(pentylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Thiophene, 2-(pentylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Thiophene, 2-(pentylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.