(4-Phenylmethoxyphenyl) 2-phenylethenesulfonate
TL;DR: (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate (CAS 109880-31-1) is a chemical compound with molecular formula C21H18O4S and molecular weight 366.0926 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-phenylmethoxyphenyl) 2-phenylethenesulfonate
Also Known As: (4-phenylmethoxyphenyl) 2-phenylethenesulfonate, 1-(2-phenylethenylsulfonyloxy)-4-phenylmethoxy-benzene, 2-PHENYL-ETHENESULFONIC ACID 4-BENZYLOXY-PHENYL ESTER
Technical Specifications
| Molecular Formula | C21H18O4S |
| Molecular Weight | 366.0926 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.0926 Da |
| Heavy Atoms | 26 |
| Complexity | 517.0 |
| SMILES | C1=CC=C(C=C1)COC2=CC=C(C=C2)OS(=O)(=O)C=CC3=CC=CC=C3 |
| InChIKey | AOPFHAGONPPDBQ-UHFFFAOYSA-N |
Chemical Property Profile of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate
Property Insights of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate
The XLogP value of 4.9 indicates that (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate. Following Lipinski's Rule of Five, (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate has 0 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 (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate?
The CAS number of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate is 109880-31-1.
What is the molecular formula of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate?
The molecular formula of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate is C21H18O4S.
What is the molecular weight of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate?
The molecular weight of (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate is 366.0926 g/mol.
Where can I buy (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate?
You can request a quote for (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate?
Yes, CoreyChem provides custom synthesis services for (4-Phenylmethoxyphenyl) 2-phenylethenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.