![1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one structure](/static/products/7001/70013-40-0.webp)
1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one
TL;DR: 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one (CAS 70013-40-0) is a chemical compound with molecular formula C12H9NO3S and molecular weight 247.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[5-(2-nitrophenyl)thiophen-2-yl]ethanone
Also Known As: 1-[5-(2-nitrophenyl)thien-2-yl]ethanone, 1-[5-(2-nitrophenyl)thiophen-2-yl]ethan-1-one, 1-[5-(2-nitrophenyl)thiophen-2-yl]ethanone, 1-(5-(2-Nitrophenyl)thiophen-2-yl)ethanone, 1-[5-(2-nitrophenyl)-2-thienyl]ethanone
| Molecular Formula | C12H9NO3S |
|---|---|
| Molecular Weight | 247.03 g/mol |
| LogP | 3.5259 |
| Topological Polar Surface Area | 60.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 247.03032 |
| Heavy Atoms | 17 |
| Complexity | 588.9416 |
Chemical Identifiers
| CAS Number | 70013-40-0 |
|---|---|
| SMILES | CC(=O)C1=CC=C(S1)C2=CC=CC=C2[N+](=O)[O-] |
Product Overview
1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one (CAS 70013-40-0), with molecular formula C12H9NO3S and molecular weight 247.03 g/mol. IUPAC: 1-[5-(2-nitrophenyl)thiophen-2-yl]ethanone.
Chemical Property Profile of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one
Property Insights of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one
The XLogP value of 3.5259 indicates that 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one 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 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one. Following Lipinski's Rule of Five, 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one 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 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one?
The CAS number of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one is 70013-40-0.
What is the molecular formula of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one?
The molecular formula of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one is C12H9NO3S.
What is the molecular weight of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one?
The molecular weight of 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one is 247.03 g/mol.
Where can I buy 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one?
You can request a quote for 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[5-(2-Nitrophenyl)thiophen-2-yl]ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.