1-Mercapto-2-propanone
TL;DR: 1-Mercapto-2-propanone (CAS 24653-75-6) is a chemical compound with molecular formula C3H6OS and molecular weight 90.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-sulfanylpropan-2-one
Also Known As: 1-Mercapto-2-propanone, Mercaptoacetone, 1-sulfanylpropan-2-one, 2-Propanone, 1-mercapto-, 1-Sulfanylacetone
| Molecular Formula | C3H6OS |
|---|---|
| Molecular Weight | 90.01 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 90.01394 |
| Heavy Atoms | 5 |
| Complexity | 42.0 |
Chemical Identifiers
| CAS Number | 24653-75-6 |
|---|---|
| SMILES | CC(=O)CS |
| InChIKey | USVCRBGYQRVTNK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Mercapto-2-propanone (CAS 24653-75-6), with molecular formula C3H6OS and molecular weight 90.01 g/mol. IUPAC: 1-sulfanylpropan-2-one.
Chemical Property Profile of 1-Mercapto-2-propanone
Property Insights of 1-Mercapto-2-propanone
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Mercapto-2-propanone. With a topological polar surface area (TPSA) of 18.1 Ų, 1-Mercapto-2-propanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Mercapto-2-propanone has 1 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-Mercapto-2-propanone?
The CAS number of 1-Mercapto-2-propanone is 24653-75-6.
What is the molecular formula of 1-Mercapto-2-propanone?
The molecular formula of 1-Mercapto-2-propanone is C3H6OS.
What is the molecular weight of 1-Mercapto-2-propanone?
The molecular weight of 1-Mercapto-2-propanone is 90.01 g/mol.
Where can I buy 1-Mercapto-2-propanone?
You can request a quote for 1-Mercapto-2-propanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Mercapto-2-propanone?
Yes, KEHONG BIO provides custom synthesis services for 1-Mercapto-2-propanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.