![3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one structure](/static/products/684/684238-79-7.png)
3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
TL;DR: 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one (CAS 684238-79-7) is a chemical compound with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-hydroxy-4-nitroanilino)-3H-2-benzofuran-1-one
Also Known As: 3-(2-hydroxy-4-nitroanilino)-3H-2-benzofuran-1-one, 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one, 3-((2-hydroxy-4-nitrophenyl)amino)isobenzofuran-1(3H)-one
| Molecular Formula | C14H10N2O5 |
|---|---|
| Molecular Weight | 286.06 g/mol |
| LogP | 2.5815 |
| Topological Polar Surface Area | 101.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 286.05896 |
| Heavy Atoms | 21 |
| Complexity | 743.8943 |
Chemical Identifiers
| CAS Number | 684238-79-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(OC2=O)NC3=C(C=C(C=C3)[N+](=O)[O-])O |
Product Overview
3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one (CAS 684238-79-7), with molecular formula C14H10N2O5 and molecular weight 286.06 g/mol. IUPAC: 3-(2-hydroxy-4-nitroanilino)-3H-2-benzofuran-1-one.
Chemical Property Profile of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
Property Insights of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one
The XLogP value of 2.5815 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one. The TPSA of 101.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one. Following Lipinski's Rule of Five, 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one has 2 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 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The CAS number of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is 684238-79-7.
What is the molecular formula of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The molecular formula of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is C14H10N2O5.
What is the molecular weight of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
The molecular weight of 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one is 286.06 g/mol.
Where can I buy 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
You can request a quote for 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one?
Yes, KEHONG BIO provides custom synthesis services for 3-[(2-hydroxy-4-nitrophenyl)amino]-2-benzofuran-1(3H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.