3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid
TL;DR: 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid (CAS 295346-56-4) is a chemical compound with molecular formula C9H8Cl2O4S and molecular weight 281.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dichlorophenyl)sulfonylpropanoic acid
Also Known As: starbld0032732, 3-((3,4-dichlorophenyl)sulfonyl)propanoic acid, 3-(3,4-dichlorophenyl)sulfonylpropanoic acid, 3-(3,4-DICHLOROBENZENESULFONYL)PROPANOIC ACID, 3-[(3,4-dichlorophenyl)sulfonyl]propanoic acid
| Molecular Formula | C9H8Cl2O4S |
|---|---|
| Molecular Weight | 281.95 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 79.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 281.95203 |
| Heavy Atoms | 16 |
| Complexity | 349.0 |
Chemical Identifiers
| CAS Number | 295346-56-4 |
|---|---|
| SMILES | C1=CC(=C(C=C1S(=O)(=O)CCC(=O)O)Cl)Cl |
| InChIKey | XEPXUQVDJALYCH-UHFFFAOYSA-N |
Product Overview
3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid (CAS 295346-56-4), with molecular formula C9H8Cl2O4S and molecular weight 281.95 g/mol. IUPAC: 3-(3,4-dichlorophenyl)sulfonylpropanoic acid.
Chemical Property Profile of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid
Property Insights of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid. The TPSA of 79.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid. Following Lipinski's Rule of Five, 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid 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 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid?
The CAS number of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid is 295346-56-4.
What is the molecular formula of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid?
The molecular formula of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid is C9H8Cl2O4S.
What is the molecular weight of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid?
The molecular weight of 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid is 281.95 g/mol.
Where can I buy 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid?
You can request a quote for 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((3,4-Dichlorophenyl)sulfonyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.