Nitroparacetamol
TL;DR: Nitroparacetamol (CAS 326850-30-0) is a chemical compound with molecular formula C12H14N2O6 and molecular weight 282.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-acetamidophenyl) 4-nitrooxybutanoate
Also Known As: Nitroparacetamol, NO-Paracetamol, nitroacetaminophen, NO-paracetamol, NicOx, NCX 701
| Molecular Formula | C12H14N2O6 |
|---|---|
| Molecular Weight | 282.09 g/mol |
| LogP | 1.5389 |
| Topological Polar Surface Area | 107.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 282.08517 |
| Heavy Atoms | 20 |
| Complexity | 485.22583 |
Chemical Identifiers
| CAS Number | 326850-30-0 |
|---|---|
| SMILES | CC(=O)NC1=CC=C(C=C1)OC(=O)CCCO[N+](=O)[O-] |
Product Overview
Nitroparacetamol (CAS 326850-30-0), with molecular formula C12H14N2O6 and molecular weight 282.09 g/mol. IUPAC: (4-acetamidophenyl) 4-nitrooxybutanoate.
Chemical Property Profile of Nitroparacetamol
Property Insights of Nitroparacetamol
The XLogP value of 1.5389 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nitroparacetamol. The TPSA of 107.77 Ų falls within the moderate polarity range, balancing permeability and solubility for Nitroparacetamol. Following Lipinski's Rule of Five, Nitroparacetamol has 1 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 Nitroparacetamol?
The CAS number of Nitroparacetamol is 326850-30-0.
What is the molecular formula of Nitroparacetamol?
The molecular formula of Nitroparacetamol is C12H14N2O6.
What is the molecular weight of Nitroparacetamol?
The molecular weight of Nitroparacetamol is 282.09 g/mol.
Where can I buy Nitroparacetamol?
You can request a quote for Nitroparacetamol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nitroparacetamol?
Yes, KEHONG BIO provides custom synthesis services for Nitroparacetamol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.