Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate
TL;DR: Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate (CAS 35283-00-2) is a chemical compound with molecular formula C11H11Br2NO4 and molecular weight 378.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate
Also Known As: ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate, 2,3-dibromo-3-(2-nitro-phenyl)-propionic acid ethyl ester
| Molecular Formula | C11H11Br2NO4 |
|---|---|
| Molecular Weight | 378.91 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 72.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.9055 |
| Heavy Atoms | 18 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 35283-00-2 |
|---|---|
| SMILES | CCOC(=O)C(C(C1=CC=CC=C1[N+](=O)[O-])Br)Br |
| InChIKey | HADIWAWDJFDYNM-UHFFFAOYSA-N |
Product Overview
Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate (CAS 35283-00-2), with molecular formula C11H11Br2NO4 and molecular weight 378.91 g/mol. IUPAC: ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate.
Chemical Property Profile of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate
Property Insights of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate
The XLogP value of 3.4 indicates that Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate. Following Lipinski's Rule of Five, Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate 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 Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate?
The CAS number of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate is 35283-00-2.
What is the molecular formula of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate?
The molecular formula of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate is C11H11Br2NO4.
What is the molecular weight of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate?
The molecular weight of Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate is 378.91 g/mol.
Where can I buy Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate?
You can request a quote for Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2,3-dibromo-3-(2-nitrophenyl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.