Phenyl-(toluene-4-sulfonyl)-acetaldehyde
TL;DR: Phenyl-(toluene-4-sulfonyl)-acetaldehyde (CAS 52629-23-9) is a chemical compound with molecular formula C15H14O3S and molecular weight 274.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-methylphenyl)sulfonyl-2-phenylacetaldehyde
Also Known As: Tosylphenylacetaldehyde, PHENYL-(TOLUENE-4-SULFONYL)-ACETALDEHYDE, J2.678.955I, 2-(4-methylbenzenesulfonyl)-2-phenylacetaldehyde, 2-(4-methylphenyl)sulfonyl-2-phenylacetaldehyde
| Molecular Formula | C15H14O3S |
|---|---|
| Molecular Weight | 274.07 g/mol |
| LogP | 2.70892 |
| Topological Polar Surface Area | 51.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 274.06638 |
| Heavy Atoms | 19 |
| Complexity | 658.2967 |
Chemical Identifiers
| CAS Number | 52629-23-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)C(C=O)C2=CC=CC=C2 |
Product Overview
Phenyl-(toluene-4-sulfonyl)-acetaldehyde (CAS 52629-23-9), with molecular formula C15H14O3S and molecular weight 274.07 g/mol. IUPAC: 2-(4-methylphenyl)sulfonyl-2-phenylacetaldehyde.
Chemical Property Profile of Phenyl-(toluene-4-sulfonyl)-acetaldehyde
Property Insights of Phenyl-(toluene-4-sulfonyl)-acetaldehyde
The XLogP value of 2.70892 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phenyl-(toluene-4-sulfonyl)-acetaldehyde. With a topological polar surface area (TPSA) of 51.21 Ų, Phenyl-(toluene-4-sulfonyl)-acetaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenyl-(toluene-4-sulfonyl)-acetaldehyde has 0 hydrogen bond donor(s) and 3 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 Phenyl-(toluene-4-sulfonyl)-acetaldehyde?
The CAS number of Phenyl-(toluene-4-sulfonyl)-acetaldehyde is 52629-23-9.
What is the molecular formula of Phenyl-(toluene-4-sulfonyl)-acetaldehyde?
The molecular formula of Phenyl-(toluene-4-sulfonyl)-acetaldehyde is C15H14O3S.
What is the molecular weight of Phenyl-(toluene-4-sulfonyl)-acetaldehyde?
The molecular weight of Phenyl-(toluene-4-sulfonyl)-acetaldehyde is 274.07 g/mol.
Where can I buy Phenyl-(toluene-4-sulfonyl)-acetaldehyde?
You can request a quote for Phenyl-(toluene-4-sulfonyl)-acetaldehyde directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenyl-(toluene-4-sulfonyl)-acetaldehyde?
Yes, KEHONG BIO provides custom synthesis services for Phenyl-(toluene-4-sulfonyl)-acetaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.