3-Ethylthiophene
TL;DR: 3-Ethylthiophene (CAS 1795-01-3) is a chemical compound with molecular formula C6H8S and molecular weight 112.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-ethylthiophene
Also Known As: 3-Ethylthiophene, THIOPHENE, 3-ETHYL-, 3-ethyl-thiophene, ETHYLTHIOPHENE, 3-Aethyl-thiophen
| Molecular Formula | C6H8S |
|---|---|
| Molecular Weight | 112.03 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 112.03467 |
| Heavy Atoms | 7 |
| Complexity | 52.0 |
| Melting Point | -89.1 °C |
| Boiling Point | 136.00 to 138.00 °C. @ 760.00 mm Hg |
Chemical Identifiers
| CAS Number | 1795-01-3 |
|---|---|
| SMILES | CCC1=CSC=C1 |
| InChIKey | SLDBAXYJAIRQMX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Ethylthiophene (CAS 1795-01-3), with molecular formula C6H8S and molecular weight 112.03 g/mol. IUPAC: 3-ethylthiophene.
Chemical Property Profile of 3-Ethylthiophene
Property Insights of 3-Ethylthiophene
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethylthiophene. With a topological polar surface area (TPSA) of 28.2 Ų, 3-Ethylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethylthiophene 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 3-Ethylthiophene?
The CAS number of 3-Ethylthiophene is 1795-01-3.
What is the molecular formula of 3-Ethylthiophene?
The molecular formula of 3-Ethylthiophene is C6H8S.
What is the molecular weight of 3-Ethylthiophene?
The molecular weight of 3-Ethylthiophene is 112.03 g/mol.
Where can I buy 3-Ethylthiophene?
You can request a quote for 3-Ethylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Ethylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 3-Ethylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.