2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-
TL;DR: 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- (CAS 41467-29-2) is a chemical compound with molecular formula C9H10OS3 and molecular weight 229.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-bis(methylsulfanyl)-1-thiophen-2-ylprop-2-en-1-one
Also Known As: Maybridge3_001264, 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-, 2-Thenoylketene dimethyldithioacetal, 3,3-bis(methylsulfanyl)-1-thiophen-2-ylprop-2-en-1-one, IDI1_012651
| Molecular Formula | C9H10OS3 |
|---|---|
| Molecular Weight | 229.99 g/mol |
| LogP | 3.4982 |
| Topological Polar Surface Area | 17.07 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.98938 |
| Heavy Atoms | 13 |
| Complexity | 294.66953 |
Chemical Identifiers
| CAS Number | 41467-29-2 |
|---|---|
| SMILES | CSC(=CC(=O)C1=CC=CS1)SC |
Product Overview
2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- (CAS 41467-29-2), with molecular formula C9H10OS3 and molecular weight 229.99 g/mol. IUPAC: 3,3-bis(methylsulfanyl)-1-thiophen-2-ylprop-2-en-1-one.
Chemical Property Profile of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-
Property Insights of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-
The XLogP value of 3.4982 indicates that 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.07 Ų, 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- has 0 hydrogen bond donor(s) and 4 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-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-?
The CAS number of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- is 41467-29-2.
What is the molecular formula of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-?
The molecular formula of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- is C9H10OS3.
What is the molecular weight of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-?
The molecular weight of 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- is 229.99 g/mol.
Where can I buy 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-?
You can request a quote for 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propen-1-one, 3,3-bis(methylthio)-1-(2-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.