3-(Prop-2-en-1-yl)thiolan-2-one
TL;DR: 3-(Prop-2-en-1-yl)thiolan-2-one (CAS 61540-16-7) is a chemical compound with molecular formula C7H10OS and molecular weight 142.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-prop-2-enylthiolan-2-one
Also Known As: 3-prop-2-enylthiolan-2-one, 3-(Prop-2-en-1-yl)thiolan-2-one
| Molecular Formula | C7H10OS |
|---|---|
| Molecular Weight | 142.05 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 142.04524 |
| Heavy Atoms | 9 |
| Complexity | 131.0 |
Chemical Identifiers
| CAS Number | 61540-16-7 |
|---|---|
| SMILES | C=CCC1CCSC1=O |
| InChIKey | GTWQFGISZURKAQ-UHFFFAOYSA-N |
Product Overview
3-(Prop-2-en-1-yl)thiolan-2-one (CAS 61540-16-7), with molecular formula C7H10OS and molecular weight 142.05 g/mol. IUPAC: 3-prop-2-enylthiolan-2-one.
Chemical Property Profile of 3-(Prop-2-en-1-yl)thiolan-2-one
Property Insights of 3-(Prop-2-en-1-yl)thiolan-2-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Prop-2-en-1-yl)thiolan-2-one. With a topological polar surface area (TPSA) of 42.4 Ų, 3-(Prop-2-en-1-yl)thiolan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Prop-2-en-1-yl)thiolan-2-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 3-(Prop-2-en-1-yl)thiolan-2-one?
The CAS number of 3-(Prop-2-en-1-yl)thiolan-2-one is 61540-16-7.
What is the molecular formula of 3-(Prop-2-en-1-yl)thiolan-2-one?
The molecular formula of 3-(Prop-2-en-1-yl)thiolan-2-one is C7H10OS.
What is the molecular weight of 3-(Prop-2-en-1-yl)thiolan-2-one?
The molecular weight of 3-(Prop-2-en-1-yl)thiolan-2-one is 142.05 g/mol.
Where can I buy 3-(Prop-2-en-1-yl)thiolan-2-one?
You can request a quote for 3-(Prop-2-en-1-yl)thiolan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Prop-2-en-1-yl)thiolan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 3-(Prop-2-en-1-yl)thiolan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.