5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid
TL;DR: 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid (CAS 115933-20-5) is a chemical compound with molecular formula C15H16O2S and molecular weight 260.0871 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-(4-tert-butylphenyl)thiophene-2-carboxylic acid
Also Known As: BB 0222917, 5-(4-tert-butylphenyl)-2-thiophenecarboxylic acid, 5-(4-tert-butylphenyl)thiophene-2-carboxylic Acid, 2-carboxy-5-(4'-(1,1-dimethylethyl)phenyl)thiophene, 5-(4-(tert-butyl)phenyl)thiophene-2-carboxylic acid
Technical Specifications
| Molecular Formula | C15H16O2S |
| Molecular Weight | 260.0871 g/mol |
| XLogP | 4.8 |
| Topological Polar Surface Area (TPSA) | 65.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.0871 Da |
| Heavy Atoms | 18 |
| Complexity | 300.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2=CC=C(S2)C(=O)O |
| InChIKey | MHVSTLSQGKGLDB-UHFFFAOYSA-N |
Chemical Property Profile of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid
Property Insights of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid
The XLogP value of 4.8 indicates that 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid. Following Lipinski's Rule of Five, 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid has 1 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 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid?
The CAS number of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid is 115933-20-5.
What is the molecular formula of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid?
The molecular formula of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid is C15H16O2S.
What is the molecular weight of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid?
The molecular weight of 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid is 260.0871 g/mol.
Where can I buy 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid?
You can request a quote for 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 5-(4-(Tert-butyl)phenyl)thiophene-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.