3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid
TL;DR: 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid (CAS 7282-58-8) is a chemical compound with molecular formula C9H7ClO2S and molecular weight 213.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-chlorophenyl)-2-sulfanylidenepropanoic acid
Also Known As: 3-(2-chlorophenyl)-2-sulfanylidenepropanoic acid, 3-(2-chloro-phenyl)-2-thioxo-propionic acid, 3-(2-chlorophenyl)-2-sulfanylidene-propanoic Acid
| Molecular Formula | C9H7ClO2S |
|---|---|
| Molecular Weight | 213.99 g/mol |
| LogP | 2.337 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 213.98553 |
| Heavy Atoms | 13 |
| Complexity | 349.22287 |
Chemical Identifiers
| CAS Number | 7282-58-8 |
|---|---|
| SMILES | C1=CC=C(C(=C1)CC(=S)C(=O)O)Cl |
Product Overview
3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid (CAS 7282-58-8), with molecular formula C9H7ClO2S and molecular weight 213.99 g/mol. IUPAC: 3-(2-chlorophenyl)-2-sulfanylidenepropanoic acid.
Chemical Property Profile of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid
Property Insights of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid
The XLogP value of 2.337 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid has 1 hydrogen bond donor(s) and 2 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 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid?
The CAS number of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid is 7282-58-8.
What is the molecular formula of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid?
The molecular formula of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid is C9H7ClO2S.
What is the molecular weight of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid?
The molecular weight of 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid is 213.99 g/mol.
Where can I buy 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid?
You can request a quote for 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(2-Chlorophenyl)-2-sulfanylidenepropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.