![2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol structure](/static/products/3334/333433-95-7.webp)
2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol
TL;DR: 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol (CAS 333433-95-7) is a chemical compound with molecular formula C9H10N4O4 and molecular weight 238.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[methyl-(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol
Also Known As: 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol, BAS 01237305, 2-(Methyl(4-nitrobenzo[c][1,2,5]oxadiazol-5-yl)amino)ethanol, 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol, ethanol, 2-[methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]-
| Molecular Formula | C9H10N4O4 |
|---|---|
| Molecular Weight | 238.07 g/mol |
| LogP | 0.5595 |
| Topological Polar Surface Area | 105.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 238.0702 |
| Heavy Atoms | 17 |
| Complexity | 552.9195 |
Chemical Identifiers
| CAS Number | 333433-95-7 |
|---|---|
| SMILES | CN(CCO)C1=C(C2=NON=C2C=C1)[N+](=O)[O-] |
Product Overview
2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol (CAS 333433-95-7), with molecular formula C9H10N4O4 and molecular weight 238.07 g/mol. IUPAC: 2-[methyl-(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol.
Chemical Property Profile of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol
Property Insights of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol
The XLogP value of 0.5595 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol. The TPSA of 105.53 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol. Following Lipinski's Rule of Five, 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol has 1 hydrogen bond donor(s) and 7 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 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol?
The CAS number of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol is 333433-95-7.
What is the molecular formula of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol?
The molecular formula of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol is C9H10N4O4.
What is the molecular weight of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol?
The molecular weight of 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol is 238.07 g/mol.
Where can I buy 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol?
You can request a quote for 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[Methyl(4-nitro-2,1,3-benzoxadiazol-5-yl)amino]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.