2-Ethyl-1-nitronaphthalene
TL;DR: 2-Ethyl-1-nitronaphthalene (CAS 130523-25-0) is a chemical compound with molecular formula C12H11NO2 and molecular weight 201.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-ethyl-1-nitronaphthalene
Also Known As: 2-Ethyl-1-nitronaphthalene, J2.838.354A
Technical Specifications
| Molecular Formula | C12H11NO2 |
| Molecular Weight | 201.07898 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.07898 Da |
| Heavy Atoms | 15 |
| Complexity | 236.0 |
| SMILES | CCC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-] |
| InChIKey | IOIHVMWSJFWYDR-UHFFFAOYSA-N |
Chemical Property Profile of 2-Ethyl-1-nitronaphthalene
Property Insights of 2-Ethyl-1-nitronaphthalene
The XLogP value of 3.8 indicates that 2-Ethyl-1-nitronaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.8 Ų, 2-Ethyl-1-nitronaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Ethyl-1-nitronaphthalene has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Ethyl-1-nitronaphthalene?
The CAS number of 2-Ethyl-1-nitronaphthalene is 130523-25-0.
What is the molecular formula of 2-Ethyl-1-nitronaphthalene?
The molecular formula of 2-Ethyl-1-nitronaphthalene is C12H11NO2.
What is the molecular weight of 2-Ethyl-1-nitronaphthalene?
The molecular weight of 2-Ethyl-1-nitronaphthalene is 201.07898 g/mol.
Where can I buy 2-Ethyl-1-nitronaphthalene?
You can request a quote for 2-Ethyl-1-nitronaphthalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Ethyl-1-nitronaphthalene?
Yes, CoreyChem provides custom synthesis services for 2-Ethyl-1-nitronaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.