![Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- structure](/static/products/5609/56096-53-8.webp)
Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-
TL;DR: Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- (CAS 56096-53-8) is a chemical compound with molecular formula C14H11ClO3S and molecular weight 294.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-chlorophenyl)sulfanyl-5-methoxybenzoic acid
Also Known As: EINECS 259-992-0, 2-(4-chlorophenyl)sulfanyl-5-methoxybenzoic acid, Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-, 2-(4-chlorophenylthio)-5-methoxybenzoic acid, 2-[(4-chlorophenyl)sulfanyl]-5-methoxybenzoic acid
| Molecular Formula | C14H11ClO3S |
|---|---|
| Molecular Weight | 294.01 g/mol |
| LogP | 4.198 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 294.01175 |
| Heavy Atoms | 19 |
| Complexity | 596.14014 |
Chemical Identifiers
| CAS Number | 56096-53-8 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)SC2=CC=C(C=C2)Cl)C(=O)O |
Product Overview
Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- (CAS 56096-53-8), with molecular formula C14H11ClO3S and molecular weight 294.01 g/mol. IUPAC: 2-(4-chlorophenyl)sulfanyl-5-methoxybenzoic acid.
Chemical Property Profile of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-
Property Insights of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-
The XLogP value of 4.198 indicates that Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- 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-[(4-chlorophenyl)thio]-5-methoxy-?
The CAS number of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- is 56096-53-8.
What is the molecular formula of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-?
The molecular formula of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- is C14H11ClO3S.
What is the molecular weight of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-?
The molecular weight of Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- is 294.01 g/mol.
Where can I buy Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy-?
You can request a quote for Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- 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-[(4-chlorophenyl)thio]-5-methoxy-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 2-[(4-chlorophenyl)thio]-5-methoxy- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.