propanoic acid, 3-(heptylthio)-, ammonium salt
TL;DR: propanoic acid, 3-(heptylthio)-, ammonium salt (CAS 126740-31-6) is a chemical compound with molecular formula C10H23NO2S and molecular weight 221.14494 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
azanium 3-heptylsulfanylpropanoate
Also Known As: 3-(Heptylthio)propanoic acid ammonium salt, Propanoic acid, 3-(heptylthio)-, ammonium salt, azanium 3-heptylsulfanylpropanoate, AMMONIUM 3-(HEPTYLSULFANYL)PROPANOATE
Technical Specifications
| Molecular Formula | C10H23NO2S |
| Molecular Weight | 221.14494 g/mol |
| XLogP | 2.2062 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 221.14494 Da |
| Heavy Atoms | 14 |
| Complexity | 121.0 |
| SMILES | CCCCCCCSCCC(=O)[O-].[NH4+] |
| InChIKey | HNEMSGLSPXDBFE-UHFFFAOYSA-N |
Chemical Property Profile of propanoic acid, 3-(heptylthio)-, ammonium salt
Property Insights of propanoic acid, 3-(heptylthio)-, ammonium salt
The XLogP value of 2.2062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for propanoic acid, 3-(heptylthio)-, ammonium salt. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for propanoic acid, 3-(heptylthio)-, ammonium salt. Following Lipinski's Rule of Five, propanoic acid, 3-(heptylthio)-, 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-(heptylthio)-, ammonium salt?
The CAS number of propanoic acid, 3-(heptylthio)-, ammonium salt is 126740-31-6.
What is the molecular formula of propanoic acid, 3-(heptylthio)-, ammonium salt?
The molecular formula of propanoic acid, 3-(heptylthio)-, ammonium salt is C10H23NO2S.
What is the molecular weight of propanoic acid, 3-(heptylthio)-, ammonium salt?
The molecular weight of propanoic acid, 3-(heptylthio)-, ammonium salt is 221.14494 g/mol.
Where can I buy propanoic acid, 3-(heptylthio)-, ammonium salt?
You can request a quote for propanoic acid, 3-(heptylthio)-, ammonium salt directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for propanoic acid, 3-(heptylthio)-, ammonium salt?
Yes, CoreyChem provides custom synthesis services for propanoic acid, 3-(heptylthio)-, ammonium salt and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.