2-(2-Nitrophenylthio)acetophenone
TL;DR: 2-(2-Nitrophenylthio)acetophenone (CAS 20940-09-4) is a chemical compound with molecular formula C14H11NO3S and molecular weight 273.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-nitrophenyl)sulfanyl-1-phenylethanone
Also Known As: 2-(2-NITROPHENYLTHIO)ACETOPHENONE, 2H-1,4-Benzothiazine,3-phenyl, 2-(2-nitrophenyl)sulfanyl-1-phenylethanone, 2-((2-Nitrophenyl)thio)-1-phenylethanone, 2-(2-nitrophenyl)sulfanyl-1-phenyl-ethanone
| Molecular Formula | C14H11NO3S |
|---|---|
| Molecular Weight | 273.05 g/mol |
| LogP | 3.5698 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 273.04596 |
| Heavy Atoms | 19 |
| Complexity | 598.6499 |
Chemical Identifiers
| CAS Number | 20940-09-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=CC=CC=C2[N+](=O)[O-] |
Product Overview
2-(2-Nitrophenylthio)acetophenone (CAS 20940-09-4), with molecular formula C14H11NO3S and molecular weight 273.05 g/mol. IUPAC: 2-(2-nitrophenyl)sulfanyl-1-phenylethanone.
Chemical Property Profile of 2-(2-Nitrophenylthio)acetophenone
Property Insights of 2-(2-Nitrophenylthio)acetophenone
The XLogP value of 3.5698 indicates that 2-(2-Nitrophenylthio)acetophenone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.21 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(2-Nitrophenylthio)acetophenone. Following Lipinski's Rule of Five, 2-(2-Nitrophenylthio)acetophenone has 0 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 2-(2-Nitrophenylthio)acetophenone?
The CAS number of 2-(2-Nitrophenylthio)acetophenone is 20940-09-4.
What is the molecular formula of 2-(2-Nitrophenylthio)acetophenone?
The molecular formula of 2-(2-Nitrophenylthio)acetophenone is C14H11NO3S.
What is the molecular weight of 2-(2-Nitrophenylthio)acetophenone?
The molecular weight of 2-(2-Nitrophenylthio)acetophenone is 273.05 g/mol.
Where can I buy 2-(2-Nitrophenylthio)acetophenone?
You can request a quote for 2-(2-Nitrophenylthio)acetophenone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Nitrophenylthio)acetophenone?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Nitrophenylthio)acetophenone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.