Cinnamic acid, o-nitro-, ethyl ester
TL;DR: Cinnamic acid, o-nitro-, ethyl ester (CAS 2437-05-0) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl (E)-3-(2-nitrophenyl)prop-2-enoate
Also Known As: (E)-Ethyl 3-(2-nitrophenyl)acrylate, Ethyl o-nitrocinnamate, Ethyl 3-(2-nitrophenyl)acrylate, Ethyl 2-nitrocinnamicacid, ethyl (E)-3-(2-nitrophenyl)prop-2-enoate
| Molecular Formula | C11H11NO4 |
|---|---|
| Molecular Weight | 221.07 g/mol |
| LogP | 2.1711 |
| Topological Polar Surface Area | 69.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 221.0688 |
| Heavy Atoms | 16 |
| Complexity | 425.74768 |
Chemical Identifiers
| CAS Number | 2437-05-0 |
|---|---|
| SMILES | CCOC(=O)/C=C/C1=CC=CC=C1[N+](=O)[O-] |
Product Overview
Cinnamic acid, o-nitro-, ethyl ester (CAS 2437-05-0), with molecular formula C11H11NO4 and molecular weight 221.07 g/mol. IUPAC: ethyl (E)-3-(2-nitrophenyl)prop-2-enoate.
Chemical Property Profile of Cinnamic acid, o-nitro-, ethyl ester
Property Insights of Cinnamic acid, o-nitro-, ethyl ester
The XLogP value of 2.1711 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cinnamic acid, o-nitro-, ethyl ester. The TPSA of 69.44 Ų falls within the moderate polarity range, balancing permeability and solubility for Cinnamic acid, o-nitro-, ethyl ester. Following Lipinski's Rule of Five, Cinnamic acid, o-nitro-, ethyl ester 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 Cinnamic acid, o-nitro-, ethyl ester?
The CAS number of Cinnamic acid, o-nitro-, ethyl ester is 2437-05-0.
What is the molecular formula of Cinnamic acid, o-nitro-, ethyl ester?
The molecular formula of Cinnamic acid, o-nitro-, ethyl ester is C11H11NO4.
What is the molecular weight of Cinnamic acid, o-nitro-, ethyl ester?
The molecular weight of Cinnamic acid, o-nitro-, ethyl ester is 221.07 g/mol.
Where can I buy Cinnamic acid, o-nitro-, ethyl ester?
You can request a quote for Cinnamic acid, o-nitro-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cinnamic acid, o-nitro-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Cinnamic acid, o-nitro-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.