![[(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate structure](/static/products/8603/86030-84-4.webp)
[(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate
TL;DR: [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate (CAS 86030-84-4) is a chemical compound with molecular formula C15H16O4S and molecular weight 292.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate
Also Known As: [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate|2-(4-methylphenyl)sulfonyloxy-2-phenyl-ethanol|(1S)-2-hydroxy-1-phenylethyl 4-methylbenzenesulfonate|1,2-Ethanediol, 1-phenyl-, 1-(4-methylbenzenesulfonate), (S)-|Toluene-4-sulfonic acid (R)-2-hydroxy-1-phenyl-ethyl ester
| Molecular Formula | C15H16O4S |
|---|---|
| Molecular Weight | 292.08 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 72.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 292.07693 |
| Heavy Atoms | 20 |
| Complexity | 373.0 |
Chemical Identifiers
| CAS Number | 86030-84-4 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O[C@H](CO)C2=CC=CC=C2 |
| InChIKey | JYWSJAIUCKNYFC-OAHLLOKOSA-N |
Product Overview
[(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate (CAS 86030-84-4), with molecular formula C15H16O4S and molecular weight 292.08 g/mol. IUPAC: [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate.
Chemical Property Profile of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate
Property Insights of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate. The TPSA of 72.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate has 1 hydrogen bond donor(s) and 4 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 [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate?
The CAS number of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate is 86030-84-4.
What is the molecular formula of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate?
The molecular formula of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate is C15H16O4S.
What is the molecular weight of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate?
The molecular weight of [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate is 292.08 g/mol.
Where can I buy [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate?
You can request a quote for [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for [(1S)-2-hydroxy-1-phenylethyl] 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.