propanoic acid, 3-(propylthio)-, ammonium salt
TL;DR: propanoic acid, 3-(propylthio)-, ammonium salt (CAS 126740-28-1) is a chemical compound with molecular formula C6H15NO2S and molecular weight 165.08235 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azanium 3-propylsulfanylpropanoate
Also Known As: 3-(Propylthio)propanoic acid ammonium salt, Propanoic acid, 3-(propylthio)-, ammonium salt, azanium 3-propylsulfanylpropanoate, AMMONIUM 3-(PROPYLSULFANYL)PROPANOATE
Technical Specifications
| Molecular Formula | C6H15NO2S |
| Molecular Weight | 165.08235 g/mol |
| XLogP | 0.6458 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 165.08235 Da |
| Heavy Atoms | 10 |
| Complexity | 77.0 |
| SMILES | CCCSCCC(=O)[O-].[NH4+] |
| InChIKey | NPBLQFWIVQVLHD-UHFFFAOYSA-N |
Chemical Property Profile of propanoic acid, 3-(propylthio)-, ammonium salt
Property Insights of propanoic acid, 3-(propylthio)-, ammonium salt
The XLogP value of 0.6458 suggests moderate lipophilicity, balancing water solubility and membrane permeability for propanoic acid, 3-(propylthio)-, ammonium salt. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for propanoic acid, 3-(propylthio)-, ammonium salt. Following Lipinski's Rule of Five, propanoic acid, 3-(propylthio)-, ammonium salt 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
What is the CAS number of propanoic acid, 3-(propylthio)-, ammonium salt?
The CAS number of propanoic acid, 3-(propylthio)-, ammonium salt is 126740-28-1.
What is the molecular formula of propanoic acid, 3-(propylthio)-, ammonium salt?
The molecular formula of propanoic acid, 3-(propylthio)-, ammonium salt is C6H15NO2S.
What is the molecular weight of propanoic acid, 3-(propylthio)-, ammonium salt?
The molecular weight of propanoic acid, 3-(propylthio)-, ammonium salt is 165.08235 g/mol.
Where can I buy propanoic acid, 3-(propylthio)-, ammonium salt?
You can request a quote for propanoic acid, 3-(propylthio)-, ammonium salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for propanoic acid, 3-(propylthio)-, ammonium salt?
Yes, CoreyChem provides custom synthesis services for propanoic acid, 3-(propylthio)-, ammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.