![[1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate structure](/static/products/680/680579-22-0.png)
[1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate
TL;DR: [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate (CAS 680579-22-0) is a chemical compound with molecular formula C13H7Cl3N2O5 and molecular weight 375.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(5-nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate
Also Known As: [1-(5-nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate|5-NITRO-2-([(2,3,3-TRICHLOROALLANOYL)OXY]ETHANIMIDOYL)-1-BENZOFURAN
| Molecular Formula | C13H7Cl3N2O5 |
|---|---|
| Molecular Weight | 375.94 g/mol |
| LogP | 4.4937 |
| Topological Polar Surface Area | 94.94 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.94205 |
| Heavy Atoms | 23 |
| Complexity | 852.4121 |
Chemical Identifiers
| CAS Number | 680579-22-0 |
|---|---|
| SMILES | CC(=NOC(=O)C(=C(Cl)Cl)Cl)C1=CC2=C(O1)C=CC(=C2)[N+](=O)[O-] |
Product Overview
[1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate (CAS 680579-22-0), with molecular formula C13H7Cl3N2O5 and molecular weight 375.94 g/mol. IUPAC: [1-(5-nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate.
Chemical Property Profile of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate
Property Insights of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate
The XLogP value of 4.4937 indicates that [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.94 Ų falls within the moderate polarity range, balancing permeability and solubility for [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate. Following Lipinski's Rule of Five, [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate has 0 hydrogen bond donor(s) and 6 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-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate?
The CAS number of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate is 680579-22-0.
What is the molecular formula of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate?
The molecular formula of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate is C13H7Cl3N2O5.
What is the molecular weight of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate?
The molecular weight of [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate is 375.94 g/mol.
Where can I buy [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate?
You can request a quote for [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for [1-(5-Nitro-1-benzofuran-2-yl)ethylideneamino] 2,3,3-trichloroprop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.