Benzoic acid, 2-benzoyl-5-chloro-
TL;DR: Benzoic acid, 2-benzoyl-5-chloro- (CAS 1147-42-8) is a chemical compound with molecular formula C14H9ClO3 and molecular weight 260.02402 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzoyl-5-chlorobenzoic acid
Also Known As: 2-benzoyl-5-chlorobenzoic acid, BENZOIC ACID, 2-BENZOYL-5-CHLORO-, 4-Chlorobenzophenone-2-carboxylic acid, 2-benzoyl-5-chloro-benzoic acid, 2-CARBOXY-4 -CHLOROBENZOPHENONE
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H9ClO3 |
| Molecular Weight | 260.02402 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 260.02402 Da |
| Heavy Atoms | 18 |
| Complexity | 323.0 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)Cl)C(=O)O |
| InChIKey | LSVPCSOPJGPTNA-UHFFFAOYSA-N |
Chemical Property Profile of Benzoic acid, 2-benzoyl-5-chloro-
Property Insights of Benzoic acid, 2-benzoyl-5-chloro-
The XLogP value of 3.5 indicates that Benzoic acid, 2-benzoyl-5-chloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Benzoic acid, 2-benzoyl-5-chloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-benzoyl-5-chloro- 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 Benzoic acid, 2-benzoyl-5-chloro-?
The CAS number of Benzoic acid, 2-benzoyl-5-chloro- is 1147-42-8.
What is the molecular formula of Benzoic acid, 2-benzoyl-5-chloro-?
The molecular formula of Benzoic acid, 2-benzoyl-5-chloro- is C14H9ClO3.
What is the molecular weight of Benzoic acid, 2-benzoyl-5-chloro-?
The molecular weight of Benzoic acid, 2-benzoyl-5-chloro- is 260.02402 g/mol.
Where can I buy Benzoic acid, 2-benzoyl-5-chloro-?
You can request a quote for Benzoic acid, 2-benzoyl-5-chloro- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benzoic acid, 2-benzoyl-5-chloro-?
Yes, CoreyChem provides custom synthesis services for Benzoic acid, 2-benzoyl-5-chloro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.