2-(3-Chloro-4-methylbenzoyl)benzoic acid
TL;DR: 2-(3-Chloro-4-methylbenzoyl)benzoic acid (CAS 15254-27-0) is a chemical compound with molecular formula C15H11ClO3 and molecular weight 274.03967 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-chloro-4-methylbenzoyl)benzoic acid
Also Known As: 2-(3-chloro-4-methylbenzoyl)benzoic acid, 2-(3-Chloro-4-toluoyl)benzoic acid, o-(3-chloro-4-toluoyl)benzoic acid, 2-(3-chloro-4-methylbenzoyl)benzoicacid, 2-(3-chloro-4-methyl-benzoyl)benzoic acid
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H11ClO3 |
| Molecular Weight | 274.03967 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.03967 Da |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
| SMILES | CC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)O)Cl |
| InChIKey | UIABSHHBLMGEQI-UHFFFAOYSA-N |
Chemical Property Profile of 2-(3-Chloro-4-methylbenzoyl)benzoic acid
Property Insights of 2-(3-Chloro-4-methylbenzoyl)benzoic acid
The XLogP value of 3.8 indicates that 2-(3-Chloro-4-methylbenzoyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, 2-(3-Chloro-4-methylbenzoyl)benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3-Chloro-4-methylbenzoyl)benzoic 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 2-(3-Chloro-4-methylbenzoyl)benzoic acid?
The CAS number of 2-(3-Chloro-4-methylbenzoyl)benzoic acid is 15254-27-0.
What is the molecular formula of 2-(3-Chloro-4-methylbenzoyl)benzoic acid?
The molecular formula of 2-(3-Chloro-4-methylbenzoyl)benzoic acid is C15H11ClO3.
What is the molecular weight of 2-(3-Chloro-4-methylbenzoyl)benzoic acid?
The molecular weight of 2-(3-Chloro-4-methylbenzoyl)benzoic acid is 274.03967 g/mol.
Where can I buy 2-(3-Chloro-4-methylbenzoyl)benzoic acid?
You can request a quote for 2-(3-Chloro-4-methylbenzoyl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(3-Chloro-4-methylbenzoyl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-(3-Chloro-4-methylbenzoyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.