2,5-Diacetylthiophene
TL;DR: 2,5-Diacetylthiophene (CAS 4927-10-0) is a chemical compound with molecular formula C8H8O2S and molecular weight 168.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-acetylthiophen-2-yl)ethanone
Also Known As: 2,5-diacetylthiophene, 1-(5-acetylthiophen-2-yl)ethanone, Avatrombopag impurity 132, 1,1'-thiene-2,5-diyldiethanone, 1,1'-(Thiophene-2,5-diyl)bisethan-1-one
| Molecular Formula | C8H8O2S |
|---|---|
| Molecular Weight | 168.02 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 62.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 168.0245 |
| Heavy Atoms | 11 |
| Complexity | 169.0 |
Chemical Identifiers
| CAS Number | 4927-10-0 |
|---|---|
| SMILES | CC(=O)C1=CC=C(S1)C(=O)C |
| InChIKey | ATLWDAOOUUVIKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-Diacetylthiophene (CAS 4927-10-0), with molecular formula C8H8O2S and molecular weight 168.02 g/mol. IUPAC: 1-(5-acetylthiophen-2-yl)ethanone.
Chemical Property Profile of 2,5-Diacetylthiophene
Property Insights of 2,5-Diacetylthiophene
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Diacetylthiophene. The TPSA of 62.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Diacetylthiophene. Following Lipinski's Rule of Five, 2,5-Diacetylthiophene has 0 hydrogen bond donor(s) and 3 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 2,5-Diacetylthiophene?
The CAS number of 2,5-Diacetylthiophene is 4927-10-0.
What is the molecular formula of 2,5-Diacetylthiophene?
The molecular formula of 2,5-Diacetylthiophene is C8H8O2S.
What is the molecular weight of 2,5-Diacetylthiophene?
The molecular weight of 2,5-Diacetylthiophene is 168.02 g/mol.
Where can I buy 2,5-Diacetylthiophene?
You can request a quote for 2,5-Diacetylthiophene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Diacetylthiophene?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Diacetylthiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.