2-Propionylthiophene
TL;DR: 2-Propionylthiophene (CAS 13679-75-9) is a chemical compound with molecular formula C7H8OS and molecular weight 140.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-thiophen-2-ylpropan-1-one
Also Known As: 2-Propionylthiophene, 1-(2-Thienyl)-1-propanone, 2-Propanoylthiophene, 1-(thiophen-2-yl)propan-1-one, Ethyl 2-Thienyl Ketone
| Molecular Formula | C7H8OS |
|---|---|
| Molecular Weight | 140.03 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 45.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 140.02959 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
| Melting Point | 57.00 °C. @ 760.00 mm Hg |
| Boiling Point | 107.00 °C. @ 11.00 mm Hg |
Chemical Identifiers
| CAS Number | 13679-75-9 |
|---|---|
| SMILES | CCC(=O)C1=CC=CS1 |
| InChIKey | MFPZQZZWAMAHOY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propionylthiophene (CAS 13679-75-9), with molecular formula C7H8OS and molecular weight 140.03 g/mol. IUPAC: 1-thiophen-2-ylpropan-1-one.
Chemical Property Profile of 2-Propionylthiophene
Property Insights of 2-Propionylthiophene
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propionylthiophene. With a topological polar surface area (TPSA) of 45.3 Ų, 2-Propionylthiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propionylthiophene 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 2-Propionylthiophene?
The CAS number of 2-Propionylthiophene is 13679-75-9.
What is the molecular formula of 2-Propionylthiophene?
The molecular formula of 2-Propionylthiophene is C7H8OS.
What is the molecular weight of 2-Propionylthiophene?
The molecular weight of 2-Propionylthiophene is 140.03 g/mol.
Where can I buy 2-Propionylthiophene?
You can request a quote for 2-Propionylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propionylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 2-Propionylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.