Propionic acid, thio-, S-isopropyl ester
TL;DR: Propionic acid, thio-, S-isopropyl ester (CAS 7383-64-4) is a chemical compound with molecular formula C6H12OS and molecular weight 132.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-propan-2-yl propanethioate
Also Known As: S-isopropyl thiol-propionate, S-Isopropyl propanethioate #, ThiopropionicacidS-isopropylester, S-propan-2-yl propanethioate, Propionic acid, thio-, S-isopropyl ester
| Molecular Formula | C6H12OS |
|---|---|
| Molecular Weight | 132.06 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 132.06088 |
| Heavy Atoms | 8 |
| Complexity | 78.0 |
Chemical Identifiers
| CAS Number | 7383-64-4 |
|---|---|
| SMILES | CCC(=O)SC(C)C |
| InChIKey | LDEJXFDTQBEVOR-UHFFFAOYSA-N |
Product Overview
Propionic acid, thio-, S-isopropyl ester (CAS 7383-64-4), with molecular formula C6H12OS and molecular weight 132.06 g/mol. IUPAC: S-propan-2-yl propanethioate.
Chemical Property Profile of Propionic acid, thio-, S-isopropyl ester
Property Insights of Propionic acid, thio-, S-isopropyl ester
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propionic acid, thio-, S-isopropyl ester. With a topological polar surface area (TPSA) of 42.4 Ų, Propionic acid, thio-, S-isopropyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid, thio-, S-isopropyl ester 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 Propionic acid, thio-, S-isopropyl ester?
The CAS number of Propionic acid, thio-, S-isopropyl ester is 7383-64-4.
What is the molecular formula of Propionic acid, thio-, S-isopropyl ester?
The molecular formula of Propionic acid, thio-, S-isopropyl ester is C6H12OS.
What is the molecular weight of Propionic acid, thio-, S-isopropyl ester?
The molecular weight of Propionic acid, thio-, S-isopropyl ester is 132.06 g/mol.
Where can I buy Propionic acid, thio-, S-isopropyl ester?
You can request a quote for Propionic acid, thio-, S-isopropyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propionic acid, thio-, S-isopropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, thio-, S-isopropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.