Ethanone, 1-(2-amino-5-nitro-3-thienyl)-
TL;DR: Ethanone, 1-(2-amino-5-nitro-3-thienyl)- (CAS 122063-37-0) is a chemical compound with molecular formula C6H6N2O3S and molecular weight 186.00992 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2-amino-5-nitrothiophen-3-yl)ethanone
Also Known As: 3-acetyl-2-amino-5-nitrothiophene, Ethanone, 1-(2-amino-5-nitro-3-thienyl)-, 1-(2-amino-5-nitrothiophen-3-yl)ethanone, 1-(2-Amino-5-nitro-3-thienyl)ethanone, 1-(2-amino-5-nitrothiophen-3-yl)ethan-1-one
Technical Specifications
| Molecular Formula | C6H6N2O3S |
| Molecular Weight | 186.00992 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 117.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 186.00992 Da |
| Heavy Atoms | 12 |
| Complexity | 215.0 |
| SMILES | CC(=O)C1=C(SC(=C1)[N+](=O)[O-])N |
| InChIKey | VOZSABVICTUWLY-UHFFFAOYSA-N |
Chemical Property Profile of Ethanone, 1-(2-amino-5-nitro-3-thienyl)-
Property Insights of Ethanone, 1-(2-amino-5-nitro-3-thienyl)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(2-amino-5-nitro-3-thienyl)-. The TPSA of 117.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 1-(2-amino-5-nitro-3-thienyl)-. Following Lipinski's Rule of Five, Ethanone, 1-(2-amino-5-nitro-3-thienyl)- has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Ethanone, 1-(2-amino-5-nitro-3-thienyl)-?
The CAS number of Ethanone, 1-(2-amino-5-nitro-3-thienyl)- is 122063-37-0.
What is the molecular formula of Ethanone, 1-(2-amino-5-nitro-3-thienyl)-?
The molecular formula of Ethanone, 1-(2-amino-5-nitro-3-thienyl)- is C6H6N2O3S.
What is the molecular weight of Ethanone, 1-(2-amino-5-nitro-3-thienyl)-?
The molecular weight of Ethanone, 1-(2-amino-5-nitro-3-thienyl)- is 186.00992 g/mol.
Where can I buy Ethanone, 1-(2-amino-5-nitro-3-thienyl)-?
You can request a quote for Ethanone, 1-(2-amino-5-nitro-3-thienyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ethanone, 1-(2-amino-5-nitro-3-thienyl)-?
Yes, CoreyChem provides custom synthesis services for Ethanone, 1-(2-amino-5-nitro-3-thienyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.