Thiophene
TL;DR: Thiophene (CAS 110-02-1) is a chemical compound with molecular formula C4H4S and molecular weight 84.00337 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
thiophene
Also Known As: THIOPHENE, Thiofuran, Thiole, Thiophen, Thiotetrole
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H4S |
| Molecular Weight | 84.00337 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 28.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 84.00337 Da |
| Heavy Atoms | 5 |
| Complexity | 22.0 |
| Melting Point | -36.8 °F (NTP, 1992) |
| Boiling Point | 183.9 °F at 760 mmHg (NTP, 1992) |
| Density | 1.0649 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 30 °F (NTP, 1992) |
| Vapor Pressure | 20 mmHg at 32 °F ; 60 mmHg at 68.2 °F; 760 mmHg at 183.9 °F (NTP, 1992) |
| Refractive Index | INDEX OF REFRACTION: 1.52684 @ 25 °C/D |
| Solubility | less than 1 mg/mL at 75 °F (NTP, 1992) |
| SMILES | C1=CSC=C1 |
| InChIKey | YTPLMLYBLZKORZ-UHFFFAOYSA-N |
Chemical Property Profile of Thiophene
Property Insights of Thiophene
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Thiophene. With a topological polar surface area (TPSA) of 28.2 Ų, Thiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Thiophene 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
What is the CAS number of Thiophene?
The CAS number of Thiophene is 110-02-1.
What is the molecular formula of Thiophene?
The molecular formula of Thiophene is C4H4S.
What is the molecular weight of Thiophene?
The molecular weight of Thiophene is 84.00337 g/mol.
Where can I buy Thiophene?
You can request a quote for Thiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Thiophene?
Yes, CoreyChem provides custom synthesis services for Thiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.
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Thiophene (CAS 110-02-1) — Complete Guide to Properties and Applications
Category: Heterocyclic Building Block | Formula: C₄H₄S | MW: 84.14 g/mol