Nonyl 3-mercaptopropionate
TL;DR: Nonyl 3-mercaptopropionate (CAS 67231-93-0) is a chemical compound with molecular formula C12H24O2S and molecular weight 232.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
nonyl 3-sulfanylpropanoate
Also Known As: Nonyl 3-mercaptopropionate, nonyl 3-sulfanylpropanoate, INMP, NONYL 3-MERCAPTOPROPANOATE, 3-Mercaptopropanoic acid nonyl ester
| Molecular Formula | C12H24O2S |
|---|---|
| Molecular Weight | 232.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 232.1497 |
| Heavy Atoms | 15 |
| Complexity | 149.0 |
Chemical Identifiers
| CAS Number | 67231-93-0 |
|---|---|
| SMILES | CCCCCCCCCOC(=O)CCS |
| InChIKey | KBTDRFBLCRALTE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Nonyl 3-mercaptopropionate (CAS 67231-93-0), with molecular formula C12H24O2S and molecular weight 232.15 g/mol. IUPAC: nonyl 3-sulfanylpropanoate.
Chemical Property Profile of Nonyl 3-mercaptopropionate
Property Insights of Nonyl 3-mercaptopropionate
The XLogP value of 4.2 indicates that Nonyl 3-mercaptopropionate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 27.3 Ų, Nonyl 3-mercaptopropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Nonyl 3-mercaptopropionate has 1 hydrogen bond donor(s) and 3 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 Nonyl 3-mercaptopropionate?
The CAS number of Nonyl 3-mercaptopropionate is 67231-93-0.
What is the molecular formula of Nonyl 3-mercaptopropionate?
The molecular formula of Nonyl 3-mercaptopropionate is C12H24O2S.
What is the molecular weight of Nonyl 3-mercaptopropionate?
The molecular weight of Nonyl 3-mercaptopropionate is 232.15 g/mol.
Where can I buy Nonyl 3-mercaptopropionate?
You can request a quote for Nonyl 3-mercaptopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nonyl 3-mercaptopropionate?
Yes, KEHONG BIO provides custom synthesis services for Nonyl 3-mercaptopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.