N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide
TL;DR: N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide (CAS 33213-29-5) is a chemical compound with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide
Also Known As: N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide, N-(3-butan-2-yl-2-hydroxy-5-nitro-phenyl)acetamide, N-[3-(Butan-2-yl)-2-hydroxy-5-nitrophenyl]ethanimidic acid
| Molecular Formula | C12H16N2O4 |
|---|---|
| Molecular Weight | 252.11 g/mol |
| LogP | 2.7723 |
| Topological Polar Surface Area | 92.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.11101 |
| Heavy Atoms | 18 |
| Complexity | 485.2109 |
Chemical Identifiers
| CAS Number | 33213-29-5 |
|---|---|
| SMILES | CCC(C)C1=C(C(=CC(=C1)[N+](=O)[O-])NC(=O)C)O |
Product Overview
N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide (CAS 33213-29-5), with molecular formula C12H16N2O4 and molecular weight 252.11 g/mol. IUPAC: N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide.
Chemical Property Profile of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide
Property Insights of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide
The XLogP value of 2.7723 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide. The TPSA of 92.47 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide. Following Lipinski's Rule of Five, N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide has 2 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 N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide?
The CAS number of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide is 33213-29-5.
What is the molecular formula of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide?
The molecular formula of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide is C12H16N2O4.
What is the molecular weight of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide?
The molecular weight of N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide is 252.11 g/mol.
Where can I buy N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide?
You can request a quote for N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(3-butan-2-yl-2-hydroxy-5-nitrophenyl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.