2-(4-Hydroxybenzoyl)benzoic acid
TL;DR: 2-(4-Hydroxybenzoyl)benzoic acid (CAS 85-57-4) is a chemical compound with molecular formula C14H10O4 and molecular weight 242.0579 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-hydroxybenzoyl)benzoic acid
Also Known As: 2-(4-Hydroxybenzoyl)benzoic acid, Phthalein acid, Hybenzoate, Hibenzate, o-(p-Hydroxybenzoyl)benzoic acid
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H10O4 |
| Molecular Weight | 242.0579 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 242.0579 Da |
| Heavy Atoms | 18 |
| Complexity | 318.0 |
| SMILES | C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)C(=O)O |
| InChIKey | YGTUPRIZNBMOFV-UHFFFAOYSA-N |
Product Description
Applications: 2-(4-Hydroxybenzoyl)benzoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-(4-Hydroxybenzoyl)benzoic acid (CAS 85-57-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
2-(4-Hydroxybenzoyl)benzoic acid is a pharmaceutical intermediate identified by CAS number 85-57-4 and the molecular formula C14H10O4 and a molecular weight of 242.06 g/mol. It is also known as 2-(4-Hydroxybenzoyl)benzoic acid and Phthalein acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-(4-Hydroxybenzoyl)benzoic acid
Property Insights of 2-(4-Hydroxybenzoyl)benzoic acid
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Hydroxybenzoyl)benzoic acid. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Hydroxybenzoyl)benzoic acid. Following Lipinski's Rule of Five, 2-(4-Hydroxybenzoyl)benzoic acid has 2 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 2-(4-Hydroxybenzoyl)benzoic acid?
The CAS number of 2-(4-Hydroxybenzoyl)benzoic acid is 85-57-4.
What is the molecular formula of 2-(4-Hydroxybenzoyl)benzoic acid?
The molecular formula of 2-(4-Hydroxybenzoyl)benzoic acid is C14H10O4.
What is the molecular weight of 2-(4-Hydroxybenzoyl)benzoic acid?
The molecular weight of 2-(4-Hydroxybenzoyl)benzoic acid is 242.0579 g/mol.
What are the applications of 2-(4-Hydroxybenzoyl)benzoic acid?
2-(4-Hydroxybenzoyl)benzoic acid is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies...
Where can I buy 2-(4-Hydroxybenzoyl)benzoic acid?
You can request a quote for 2-(4-Hydroxybenzoyl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4-Hydroxybenzoyl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(4-Hydroxybenzoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.