1-Thiophen-2-ylpent-1-en-3-one
TL;DR: 1-Thiophen-2-ylpent-1-en-3-one (CAS 937-68-8) is a chemical compound with molecular formula C9H10OS and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-thiophen-2-ylpent-1-en-3-one
Also Known As: 1-thiophen-2-ylpent-1-en-3-one, 1-thiophen-2-yl-pent-1-en-3-one
| Molecular Formula | C9H10OS |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 2.7404 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.04524 |
| Heavy Atoms | 11 |
| Complexity | 246.53627 |
Chemical Identifiers
| CAS Number | 937-68-8 |
|---|---|
| SMILES | CCC(=O)C=CC1=CC=CS1 |
Product Overview
1-Thiophen-2-ylpent-1-en-3-one (CAS 937-68-8), with molecular formula C9H10OS and molecular weight 166.05 g/mol. IUPAC: 1-thiophen-2-ylpent-1-en-3-one.
Chemical Property Profile of 1-Thiophen-2-ylpent-1-en-3-one
Property Insights of 1-Thiophen-2-ylpent-1-en-3-one
The XLogP value of 2.7404 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Thiophen-2-ylpent-1-en-3-one. With a topological polar surface area (TPSA) of 17.07 Ų, 1-Thiophen-2-ylpent-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Thiophen-2-ylpent-1-en-3-one 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 1-Thiophen-2-ylpent-1-en-3-one?
The CAS number of 1-Thiophen-2-ylpent-1-en-3-one is 937-68-8.
What is the molecular formula of 1-Thiophen-2-ylpent-1-en-3-one?
The molecular formula of 1-Thiophen-2-ylpent-1-en-3-one is C9H10OS.
What is the molecular weight of 1-Thiophen-2-ylpent-1-en-3-one?
The molecular weight of 1-Thiophen-2-ylpent-1-en-3-one is 166.05 g/mol.
Where can I buy 1-Thiophen-2-ylpent-1-en-3-one?
You can request a quote for 1-Thiophen-2-ylpent-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Thiophen-2-ylpent-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-Thiophen-2-ylpent-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.