2-Tert-butyl-5-methyl-4-nitrosophenol
TL;DR: 2-Tert-butyl-5-methyl-4-nitrosophenol (CAS 5435-72-3) is a chemical compound with molecular formula C11H15NO2 and molecular weight 193.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-tert-butyl-5-methyl-4-nitrosophenol
Also Known As: 2-tert-butyl-5-methyl-4-nitrosophenol, 2-tert-Butyl-5-methyl-4-nitroso-phenol, 2-(tert-butyl)4-nitroso-5-methylphenol, 5-methyl-4-nitroso-2-tert-butyl-phenol, 2-(tert-butyl)-4-nitroso-5-methylphenol
| Molecular Formula | C11H15NO2 |
|---|---|
| Molecular Weight | 193.11 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.11028 |
| Heavy Atoms | 14 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 5435-72-3 |
|---|---|
| SMILES | CC1=CC(=C(C=C1N=O)C(C)(C)C)O |
| InChIKey | ADSFEUISZHRJTO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Tert-butyl-5-methyl-4-nitrosophenol (CAS 5435-72-3), with molecular formula C11H15NO2 and molecular weight 193.11 g/mol. IUPAC: 2-tert-butyl-5-methyl-4-nitrosophenol.
Chemical Property Profile of 2-Tert-butyl-5-methyl-4-nitrosophenol
Property Insights of 2-Tert-butyl-5-methyl-4-nitrosophenol
The XLogP value of 3.0 indicates that 2-Tert-butyl-5-methyl-4-nitrosophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, 2-Tert-butyl-5-methyl-4-nitrosophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Tert-butyl-5-methyl-4-nitrosophenol 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-5-methyl-4-nitrosophenol?
The CAS number of 2-Tert-butyl-5-methyl-4-nitrosophenol is 5435-72-3.
What is the molecular formula of 2-Tert-butyl-5-methyl-4-nitrosophenol?
The molecular formula of 2-Tert-butyl-5-methyl-4-nitrosophenol is C11H15NO2.
What is the molecular weight of 2-Tert-butyl-5-methyl-4-nitrosophenol?
The molecular weight of 2-Tert-butyl-5-methyl-4-nitrosophenol is 193.11 g/mol.
Where can I buy 2-Tert-butyl-5-methyl-4-nitrosophenol?
You can request a quote for 2-Tert-butyl-5-methyl-4-nitrosophenol 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-5-methyl-4-nitrosophenol?
Yes, KEHONG BIO provides custom synthesis services for 2-Tert-butyl-5-methyl-4-nitrosophenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.