2-(4-Acetoxyphenyl)benzothiophene
TL;DR: 2-(4-Acetoxyphenyl)benzothiophene (CAS 132932-62-8) is a chemical compound with molecular formula C16H12O2S and molecular weight 268.0558 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(1-benzothiophen-2-yl)phenyl] acetate
Also Known As: 2-Benzothiophene, 2- benzothiophene, 2-(4-ACETOXYPHENYL)BENZOTHIOPHENE, [4-(1-benzothiophen-2-yl)phenyl] acetate, Ethanone,1-(4-benzo[b]thien-2-ylphenyl)-
Technical Specifications
| Molecular Formula | C16H12O2S |
| Molecular Weight | 268.0558 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.0558 Da |
| Heavy Atoms | 19 |
| Complexity | 323.0 |
| SMILES | CC(=O)OC1=CC=C(C=C1)C2=CC3=CC=CC=C3S2 |
| InChIKey | DHRGTVQDDWWSMS-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4-Acetoxyphenyl)benzothiophene
Property Insights of 2-(4-Acetoxyphenyl)benzothiophene
The XLogP value of 4.4 indicates that 2-(4-Acetoxyphenyl)benzothiophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, 2-(4-Acetoxyphenyl)benzothiophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(4-Acetoxyphenyl)benzothiophene 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
What is the CAS number of 2-(4-Acetoxyphenyl)benzothiophene?
The CAS number of 2-(4-Acetoxyphenyl)benzothiophene is 132932-62-8.
What is the molecular formula of 2-(4-Acetoxyphenyl)benzothiophene?
The molecular formula of 2-(4-Acetoxyphenyl)benzothiophene is C16H12O2S.
What is the molecular weight of 2-(4-Acetoxyphenyl)benzothiophene?
The molecular weight of 2-(4-Acetoxyphenyl)benzothiophene is 268.0558 g/mol.
Where can I buy 2-(4-Acetoxyphenyl)benzothiophene?
You can request a quote for 2-(4-Acetoxyphenyl)benzothiophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Acetoxyphenyl)benzothiophene?
Yes, CoreyChem provides custom synthesis services for 2-(4-Acetoxyphenyl)benzothiophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.