p-Nitrocresol
TL;DR: p-Nitrocresol (CAS 58882-68-1) is a chemical compound with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-4-nitrophenol;3-methyl-4-nitrophenol
Also Known As: P-NITROCRESOL, 2-Methyl-4-nitro-phenol, 2-methyl-4-nitrophenol; 3-methyl-4-nitrophenol, 2-methyl-4-nitrophenol,3-methyl-4-nitrophenol, 2-methyl-4-nitro-phenol; 3-methyl-4-nitro-phenol
| Molecular Formula | C14H14N2O6 |
|---|---|
| Molecular Weight | 306.09 g/mol |
| LogP | 3.22 |
| Topological Polar Surface Area | 132.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 306.08517 |
| Heavy Atoms | 22 |
| Complexity | 309.0 |
Chemical Identifiers
| CAS Number | 58882-68-1 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)[N+](=O)[O-])O.CC1=C(C=CC(=C1)O)[N+](=O)[O-] |
| InChIKey | FVVBEMKXRUJJFF-UHFFFAOYSA-N |
Product Overview
p-Nitrocresol (CAS 58882-68-1), with molecular formula C14H14N2O6 and molecular weight 306.09 g/mol. IUPAC: 2-methyl-4-nitrophenol;3-methyl-4-nitrophenol.
Chemical Property Profile of p-Nitrocresol
Property Insights of p-Nitrocresol
The XLogP value of 3.22 indicates that p-Nitrocresol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 132.0 Ų falls within the moderate polarity range, balancing permeability and solubility for p-Nitrocresol. Following Lipinski's Rule of Five, p-Nitrocresol 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 p-Nitrocresol?
The CAS number of p-Nitrocresol is 58882-68-1.
What is the molecular formula of p-Nitrocresol?
The molecular formula of p-Nitrocresol is C14H14N2O6.
What is the molecular weight of p-Nitrocresol?
The molecular weight of p-Nitrocresol is 306.09 g/mol.
Where can I buy p-Nitrocresol?
You can request a quote for p-Nitrocresol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for p-Nitrocresol?
Yes, KEHONG BIO provides custom synthesis services for p-Nitrocresol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.