3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid
TL;DR: 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid (CAS 33912-11-7) is a chemical compound with molecular formula C9H8N2O6S and molecular weight 272.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,4-dinitrophenyl)sulfanylpropanoic acid
Also Known As: 3-({2,4-dinitrophenyl}sulfanyl)propanoic acid, 3-(2,4-dinitrophenyl)sulfanylpropanoic acid, 3-(2,4-dinitrophenylthio)propanoic acid, 3-[(2,4-dinitrophenyl)thio]propanoic acid, 3-[(2,4-dinitrophenyl)thio]propionic acid
| Molecular Formula | C9H8N2O6S |
|---|---|
| Molecular Weight | 272.01 g/mol |
| LogP | 2.0698 |
| Topological Polar Surface Area | 123.58 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 272.0103 |
| Heavy Atoms | 18 |
| Complexity | 503.83127 |
Chemical Identifiers
| CAS Number | 33912-11-7 |
|---|---|
| SMILES | C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])SCCC(=O)O |
Product Overview
3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid (CAS 33912-11-7), with molecular formula C9H8N2O6S and molecular weight 272.01 g/mol. IUPAC: 3-(2,4-dinitrophenyl)sulfanylpropanoic acid.
Chemical Property Profile of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid
Property Insights of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid
The XLogP value of 2.0698 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid. The TPSA of 123.58 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid. Following Lipinski's Rule of Five, 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid has 1 hydrogen bond donor(s) and 6 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-({2,4-Dinitrophenyl}sulfanyl)propanoic acid?
The CAS number of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid is 33912-11-7.
What is the molecular formula of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid?
The molecular formula of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid is C9H8N2O6S.
What is the molecular weight of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid?
The molecular weight of 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid is 272.01 g/mol.
Where can I buy 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid?
You can request a quote for 3-({2,4-Dinitrophenyl}sulfanyl)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-({2,4-Dinitrophenyl}sulfanyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-({2,4-Dinitrophenyl}sulfanyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.