Propanoic acid, 3-mercapto-, ammonium salt (1:1)
TL;DR: Propanoic acid, 3-mercapto-, ammonium salt (1:1) (CAS 57862-95-0) is a chemical compound with molecular formula C3H9NO2S and molecular weight 123.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
azanium 3-sulfanylpropanoate
Also Known As: Ammonium 3-mercaptopropionate, Ammonium 3-thiopropionate, Ammoniummercaptopropionate, ammonium3-mercaptopropionate, azanium 3-sulfanylpropanoate
| Molecular Formula | C3H9NO2S |
|---|---|
| Molecular Weight | 123.04 g/mol |
| LogP | -0.5676 |
| Topological Polar Surface Area | 42.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 123.0354 |
| Heavy Atoms | 7 |
| Complexity | 47.0 |
Chemical Identifiers
| CAS Number | 57862-95-0 |
|---|---|
| SMILES | C(CS)C(=O)[O-].[NH4+] |
| InChIKey | HCTNQQPHPIGLQV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanoic acid, 3-mercapto-, ammonium salt (1:1) (CAS 57862-95-0), with molecular formula C3H9NO2S and molecular weight 123.04 g/mol. IUPAC: azanium 3-sulfanylpropanoate.
Chemical Property Profile of Propanoic acid, 3-mercapto-, ammonium salt (1:1)
Property Insights of Propanoic acid, 3-mercapto-, ammonium salt (1:1)
The XLogP value of -0.5676 indicates that Propanoic acid, 3-mercapto-, ammonium salt (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.1 Ų, Propanoic acid, 3-mercapto-, ammonium salt (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanoic acid, 3-mercapto-, ammonium salt (1:1) has 2 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 Propanoic acid, 3-mercapto-, ammonium salt (1:1)?
The CAS number of Propanoic acid, 3-mercapto-, ammonium salt (1:1) is 57862-95-0.
What is the molecular formula of Propanoic acid, 3-mercapto-, ammonium salt (1:1)?
The molecular formula of Propanoic acid, 3-mercapto-, ammonium salt (1:1) is C3H9NO2S.
What is the molecular weight of Propanoic acid, 3-mercapto-, ammonium salt (1:1)?
The molecular weight of Propanoic acid, 3-mercapto-, ammonium salt (1:1) is 123.04 g/mol.
Where can I buy Propanoic acid, 3-mercapto-, ammonium salt (1:1)?
You can request a quote for Propanoic acid, 3-mercapto-, ammonium salt (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanoic acid, 3-mercapto-, ammonium salt (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Propanoic acid, 3-mercapto-, ammonium salt (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.