邻((对氯苯基)二硫代)苯甲酸
TL;DR: 邻((对氯苯基)二硫代)苯甲酸 (CAS 25562-43-0) is a chemical compound with molecular formula C13H9ClO2S2 and molecular weight 295.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
邻((对氯苯基)二硫代)苯甲酸
2-[(4-chlorophenyl)disulfanyl]benzoic acid
Also Known As: o-((p-Chlorophenyl)dithio)benzoic acid, BENZOIC ACID, o-((p-CHLOROPHENYL)DITHIO)-, 2-[(4-chlorophenyl)disulfanyl]benzoic acid, o-[(p-Chlorophenyl)dithio]benzoic acid, 2-Carboxyphenyl(4-chlorophenyl) persulfide
| Molecular Formula | C13H9ClO2S2 |
|---|---|
| Molecular Weight | 295.97 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.97324 |
| Heavy Atoms | 18 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 25562-43-0 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)SSC2=CC=C(C=C2)Cl |
| InChIKey | KVCRNYQZAMPNQU-UHFFFAOYSA-N |
Product Overview
邻((对氯苯基)二硫代)苯甲酸 (CAS 25562-43-0), with molecular formula C13H9ClO2S2 and molecular weight 295.97 g/mol. IUPAC: 2-[(4-chlorophenyl)disulfanyl]benzoic acid.
Chemical Property Profile of 邻((对氯苯基)二硫代)苯甲酸
Property Insights of 邻((对氯苯基)二硫代)苯甲酸
The XLogP value of 4.2 indicates that 邻((对氯苯基)二硫代)苯甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 邻((对氯苯基)二硫代)苯甲酸. Following Lipinski's Rule of Five, 邻((对氯苯基)二硫代)苯甲酸 has 1 hydrogen bond donor(s) and 4 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 邻((对氯苯基)二硫代)苯甲酸?
The CAS number of 邻((对氯苯基)二硫代)苯甲酸 is 25562-43-0.
What is the molecular formula of 邻((对氯苯基)二硫代)苯甲酸?
The molecular formula of 邻((对氯苯基)二硫代)苯甲酸 is C13H9ClO2S2.
What is the molecular weight of 邻((对氯苯基)二硫代)苯甲酸?
The molecular weight of 邻((对氯苯基)二硫代)苯甲酸 is 295.97 g/mol.
Where can I buy 邻((对氯苯基)二硫代)苯甲酸?
You can request a quote for 邻((对氯苯基)二硫代)苯甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 邻((对氯苯基)二硫代)苯甲酸?
Yes, KEHONG BIO provides custom synthesis services for 邻((对氯苯基)二硫代)苯甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.