2-Tert-butyl-4-methyl-6-nitrophenol
TL;DR: 2-Tert-butyl-4-methyl-6-nitrophenol (CAS 70444-48-3) is a chemical compound with molecular formula C11H15NO3 and molecular weight 209.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-4-methyl-6-nitrophenol
Also Known As: 2-tert-butyl-4-methyl-6-nitrophenol, SALOR-INT L498483-1EA, 6-(tert-butyl)-4-methyl-2-nitrophenol, LABOTEST-BB LT00239246, 2-Nitro-4-methyl-6-tert-butylphenol
| Molecular Formula | C11H15NO3 |
|---|---|
| Molecular Weight | 209.11 g/mol |
| LogP | 2.90632 |
| Topological Polar Surface Area | 63.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 209.1052 |
| Heavy Atoms | 15 |
| Complexity | 405.02945 |
Chemical Identifiers
| CAS Number | 70444-48-3 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)[N+](=O)[O-])O)C(C)(C)C |
Product Overview
2-Tert-butyl-4-methyl-6-nitrophenol (CAS 70444-48-3), with molecular formula C11H15NO3 and molecular weight 209.11 g/mol. IUPAC: 2-tert-butyl-4-methyl-6-nitrophenol.
Chemical Property Profile of 2-Tert-butyl-4-methyl-6-nitrophenol
Property Insights of 2-Tert-butyl-4-methyl-6-nitrophenol
The XLogP value of 2.90632 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Tert-butyl-4-methyl-6-nitrophenol. The TPSA of 63.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Tert-butyl-4-methyl-6-nitrophenol. Following Lipinski's Rule of Five, 2-Tert-butyl-4-methyl-6-nitrophenol has 1 hydrogen bond donor(s) and 3 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-Tert-butyl-4-methyl-6-nitrophenol?
The CAS number of 2-Tert-butyl-4-methyl-6-nitrophenol is 70444-48-3.
What is the molecular formula of 2-Tert-butyl-4-methyl-6-nitrophenol?
The molecular formula of 2-Tert-butyl-4-methyl-6-nitrophenol is C11H15NO3.
What is the molecular weight of 2-Tert-butyl-4-methyl-6-nitrophenol?
The molecular weight of 2-Tert-butyl-4-methyl-6-nitrophenol is 209.11 g/mol.
Where can I buy 2-Tert-butyl-4-methyl-6-nitrophenol?
You can request a quote for 2-Tert-butyl-4-methyl-6-nitrophenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Tert-butyl-4-methyl-6-nitrophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-4-methyl-6-nitrophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.