Acetophenone, 2-((p-nitrophenyl)thio)-
TL;DR: Acetophenone, 2-((p-nitrophenyl)thio)- (CAS 33046-48-9) 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-(4-nitrophenyl)sulfanyl-1-phenylethanone
Also Known As: p-Nitrophenylthioacetophenone, NCIOpen2_007088, ACETOPHENONE, 2-((p-NITROPHENYL)THIO)-, 2-(4-nitrophenyl)sulfanyl-1-phenylethanone, Acetophenone, 2-[(p-nitrophenyl)thio]-
| Molecular Formula | C14H11NO3S |
|---|---|
| Molecular Weight | 273.05 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 88.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 273.04596 |
| Heavy Atoms | 19 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 33046-48-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)CSC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | MSDOBISTMBKIFE-UHFFFAOYSA-N |
Product Overview
Acetophenone, 2-((p-nitrophenyl)thio)- (CAS 33046-48-9), with molecular formula C14H11NO3S and molecular weight 273.05 g/mol. IUPAC: 2-(4-nitrophenyl)sulfanyl-1-phenylethanone.
Chemical Property Profile of Acetophenone, 2-((p-nitrophenyl)thio)-
Property Insights of Acetophenone, 2-((p-nitrophenyl)thio)-
The XLogP value of 3.7 indicates that Acetophenone, 2-((p-nitrophenyl)thio)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Acetophenone, 2-((p-nitrophenyl)thio)-. Following Lipinski's Rule of Five, Acetophenone, 2-((p-nitrophenyl)thio)- 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 Acetophenone, 2-((p-nitrophenyl)thio)-?
The CAS number of Acetophenone, 2-((p-nitrophenyl)thio)- is 33046-48-9.
What is the molecular formula of Acetophenone, 2-((p-nitrophenyl)thio)-?
The molecular formula of Acetophenone, 2-((p-nitrophenyl)thio)- is C14H11NO3S.
What is the molecular weight of Acetophenone, 2-((p-nitrophenyl)thio)-?
The molecular weight of Acetophenone, 2-((p-nitrophenyl)thio)- is 273.05 g/mol.
Where can I buy Acetophenone, 2-((p-nitrophenyl)thio)-?
You can request a quote for Acetophenone, 2-((p-nitrophenyl)thio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetophenone, 2-((p-nitrophenyl)thio)-?
Yes, KEHONG BIO provides custom synthesis services for Acetophenone, 2-((p-nitrophenyl)thio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.