RefChem:315992
TL;DR: RefChem:315992 (CAS 102582-88-7) is a chemical compound with molecular formula C15H25NO5S and molecular weight 331.14536 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methylphenyl)sulfanylacetate;tris(2-hydroxyethyl)azanium
Also Known As: (4-Methylphenylthio)acetic acid triethanolamine, (4-Methylphenylthio)aceticacidtriethanolamine, ((4-Methylphenyl)thio)acetic acid 2,2',2''-nitrilotris(ethanol) (1:1), (p-Tolylthio)acetic acid compd. with 2,2',2''-nitrilotrisethanol (1:1), 2-(4-methylphenyl)sulfanylacetate; tris(2-hydroxyethyl)azanium
Technical Specifications
| Molecular Formula | C15H25NO5S |
| Molecular Weight | 331.14536 g/mol |
| XLogP | -2.31 |
| Topological Polar Surface Area (TPSA) | 131.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 331.14536 Da |
| Heavy Atoms | 22 |
| Complexity | 201.0 |
| SMILES | CC1=CC=C(C=C1)SCC(=O)[O-].C(CO)[NH+](CCO)CCO |
| InChIKey | KOOKZKIVNMVZBT-UHFFFAOYSA-N |
Chemical Property Profile of RefChem:315992
Property Insights of RefChem:315992
The XLogP value of -2.31 indicates that RefChem:315992 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:315992. Following Lipinski's Rule of Five, RefChem:315992 has 4 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of RefChem:315992?
The CAS number of RefChem:315992 is 102582-88-7.
What is the molecular formula of RefChem:315992?
The molecular formula of RefChem:315992 is C15H25NO5S.
What is the molecular weight of RefChem:315992?
The molecular weight of RefChem:315992 is 331.14536 g/mol.
Where can I buy RefChem:315992?
You can request a quote for RefChem:315992 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for RefChem:315992?
Yes, CoreyChem provides custom synthesis services for RefChem:315992 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.