1-Ethoxy-2-(2-nitroprop-1-enyl)benzene
TL;DR: 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene (CAS 18982-39-3) is a chemical compound with molecular formula C11H13NO3 and molecular weight 207.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethoxy-2-(2-nitroprop-1-enyl)benzene
Also Known As: 1-ethoxy-2-(2-nitroprop-1-enyl)benzene, 1-(2-Ethoxy-phenyl)-2-nitro-prop-1-en, 1-ethoxy-2-(2-nitroprop-1-en-1-yl)benzene
| Molecular Formula | C11H13NO3 |
|---|---|
| Molecular Weight | 207.09 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 55.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 207.08954 |
| Heavy Atoms | 15 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 18982-39-3 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C=C(C)[N+](=O)[O-] |
| InChIKey | PQACPGNUJJIEOZ-UHFFFAOYSA-N |
Product Overview
1-Ethoxy-2-(2-nitroprop-1-enyl)benzene (CAS 18982-39-3), with molecular formula C11H13NO3 and molecular weight 207.09 g/mol. IUPAC: 1-ethoxy-2-(2-nitroprop-1-enyl)benzene.
Chemical Property Profile of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene
Property Insights of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene. With a topological polar surface area (TPSA) of 55.1 Ų, 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene has 0 hydrogen bond donor(s) and 3 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-Ethoxy-2-(2-nitroprop-1-enyl)benzene?
The CAS number of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene is 18982-39-3.
What is the molecular formula of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene?
The molecular formula of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene is C11H13NO3.
What is the molecular weight of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene?
The molecular weight of 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene is 207.09 g/mol.
Where can I buy 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene?
You can request a quote for 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Ethoxy-2-(2-nitroprop-1-enyl)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.