Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-
TL;DR: Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- (CAS 955-03-3) is a chemical compound with molecular formula C14H21NO2 and molecular weight 235.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-nitrosophenol
Also Known As: 2,6-Di-tert-butyl-4-nitrosophenol, 2,6-di-tert-butyl-p-benzoquinone-4-oxime, 2,6-Ditert-butyl-4-nitrosophenol, Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-, 2,6-Di(tert-butyl)-4-nitrosophenol
| Molecular Formula | C14H21NO2 |
|---|---|
| Molecular Weight | 235.16 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 49.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.15723 |
| Heavy Atoms | 17 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 955-03-3 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)N=O |
| InChIKey | JLOKPJOOVQELMO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 10 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- (CAS 955-03-3), with molecular formula C14H21NO2 and molecular weight 235.16 g/mol. IUPAC: 2,6-ditert-butyl-4-nitrosophenol.
Chemical Property Profile of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-
Property Insights of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-
The XLogP value of 4.3 indicates that Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.7 Ų, Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- 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 Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-?
The CAS number of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- is 955-03-3.
What is the molecular formula of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-?
The molecular formula of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- is C14H21NO2.
What is the molecular weight of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-?
The molecular weight of Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- is 235.16 g/mol.
Where can I buy Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-?
You can request a quote for Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso-?
Yes, KEHONG BIO provides custom synthesis services for Phenol, 2,6-bis(1,1-dimethylethyl)-4-nitroso- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.