Propionic acid, thio-, S-heptyl ester
TL;DR: Propionic acid, thio-, S-heptyl ester (CAS 2432-45-3) is a chemical compound with molecular formula C10H20OS and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-heptyl propanethioate
Also Known As: S-Heptyl propanethioate, O-heptyl propanethioate, S-Heptyl propanethioate #, 1-(heptylsulfanyl)propan-1-one, Thiopropionic acid S-heptyl ester
| Molecular Formula | C10H20OS |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 188.12349 |
| Heavy Atoms | 12 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 2432-45-3 |
|---|---|
| SMILES | CCCCCCCSC(=O)CC |
| InChIKey | QIZXAEKUIZFKAZ-UHFFFAOYSA-N |
Product Overview
Propionic acid, thio-, S-heptyl ester (CAS 2432-45-3), with molecular formula C10H20OS and molecular weight 188.12 g/mol. IUPAC: S-heptyl propanethioate.
Chemical Property Profile of Propionic acid, thio-, S-heptyl ester
Property Insights of Propionic acid, thio-, S-heptyl ester
The XLogP value of 4.0 indicates that Propionic acid, thio-, S-heptyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, Propionic acid, thio-, S-heptyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propionic acid, thio-, S-heptyl 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-heptyl ester?
The CAS number of Propionic acid, thio-, S-heptyl ester is 2432-45-3.
What is the molecular formula of Propionic acid, thio-, S-heptyl ester?
The molecular formula of Propionic acid, thio-, S-heptyl ester is C10H20OS.
What is the molecular weight of Propionic acid, thio-, S-heptyl ester?
The molecular weight of Propionic acid, thio-, S-heptyl ester is 188.12 g/mol.
Where can I buy Propionic acid, thio-, S-heptyl ester?
You can request a quote for Propionic acid, thio-, S-heptyl 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-heptyl ester?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, thio-, S-heptyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.