Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)
TL;DR: Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) (CAS 105892-16-8) is a chemical compound with molecular formula C11H17NO3S and molecular weight 243.09291 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxyethylazanium;2-(4-methylphenyl)sulfanylacetate
Also Known As: ((4-Methylphenyl)thio)acetic acid 2-aminoethanol (1:1), 2-hydroxyethylazanium; 2-(4-methylphenyl)sulfanylacetate, ACETIC ACID, ((4-METHYLPHENYL)THIO)-, compd. with 2-AMINOETHANOL (1:1), ((4-Methylphenyl)thio)aceticacid2-aminoethanol(1:1), 2-hydroxyethanaminium[(4-methylphenyl)sulfanyl]acetate
Technical Specifications
| Molecular Formula | C11H17NO3S |
| Molecular Weight | 243.09291 g/mol |
| XLogP | -0.94 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 243.09291 Da |
| Heavy Atoms | 16 |
| Complexity | 155.0 |
| SMILES | CC1=CC=C(C=C1)SCC(=O)[O-].C(CO)[NH3+] |
| InChIKey | IGBQDMIZUMHNIK-UHFFFAOYSA-N |
Chemical Property Profile of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)
Property Insights of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)
The XLogP value of -0.94 indicates that Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1). Following Lipinski's Rule of Five, Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)?
The CAS number of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) is 105892-16-8.
What is the molecular formula of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)?
The molecular formula of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) is C11H17NO3S.
What is the molecular weight of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)?
The molecular weight of Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) is 243.09291 g/mol.
Where can I buy Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)?
You can request a quote for Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1)?
Yes, CoreyChem provides custom synthesis services for Acetic acid, ((4-methylphenyl)thio)-, compd. with 2-aminoethanol (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.