Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-
TL;DR: Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- (CAS 71550-20-4) is a chemical compound with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-chloro-5-methylbenzoyl)benzoic acid
Also Known As: 2-(2-Chloro-5-methylbenzoyl)benzoic acid, Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-, 2-[2-Chloro-5-methylbenzoyl]benzoic acid, 2-(2-chloro-5-methyl-benzoyl)benzoic acid, RefChem:118319
| Molecular Formula | C15H11ClO3 |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.03967 |
| Heavy Atoms | 19 |
| Complexity | 355.0 |
Chemical Identifiers
| CAS Number | 71550-20-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)Cl)C(=O)C2=CC=CC=C2C(=O)O |
| InChIKey | OACHMRGCIDBGJG-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- (CAS 71550-20-4), with molecular formula C15H11ClO3 and molecular weight 274.04 g/mol. IUPAC: 2-(2-chloro-5-methylbenzoyl)benzoic acid.
Chemical Property Profile of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-
Property Insights of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-
The XLogP value of 3.8 indicates that Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- 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-(2-chloro-5-methylbenzoyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- 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
Frequently Asked Questions
What is the CAS number of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-?
The CAS number of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- is 71550-20-4.
What is the molecular formula of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-?
The molecular formula of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- is C15H11ClO3.
What is the molecular weight of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-?
The molecular weight of Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- is 274.04 g/mol.
Where can I buy Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-?
You can request a quote for Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 2-(2-chloro-5-methylbenzoyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-(2-chloro-5-methylbenzoyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.