2,6-Ditert-butyl-4-diazoniophenolate
TL;DR: 2,6-Ditert-butyl-4-diazoniophenolate (CAS 955-02-2) is a chemical compound with molecular formula C14H20N2O and molecular weight 232.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-ditert-butyl-4-diazoniophenolate
Also Known As: 2,6-ditert-butyl-4-diazoniophenolate, 2,6-Di-tert-butyl-4-diazoniophenolate, 4-diazo-2,6-di-t-butyl-cyclohexa-2,5-dienone, 2,6-Bis(1,1-dimethylethyl)-4-diazocyclohexa-2,5-dien-1-one, 2,6-Di-tert-butyl-4-diazo-2,5-cyclohexadien-1-one
| Molecular Formula | C14H20N2O |
|---|---|
| Molecular Weight | 232.16 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.15756 |
| Heavy Atoms | 17 |
| Complexity | 291.0 |
Chemical Identifiers
| CAS Number | 955-02-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=CC(=C1[O-])C(C)(C)C)[N+]#N |
| InChIKey | NRJGCANPWXHZFH-UHFFFAOYSA-N |
Product Overview
2,6-Ditert-butyl-4-diazoniophenolate (CAS 955-02-2), with molecular formula C14H20N2O and molecular weight 232.16 g/mol. IUPAC: 2,6-ditert-butyl-4-diazoniophenolate.
Chemical Property Profile of 2,6-Ditert-butyl-4-diazoniophenolate
Property Insights of 2,6-Ditert-butyl-4-diazoniophenolate
The XLogP value of 6.2 indicates that 2,6-Ditert-butyl-4-diazoniophenolate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.2 Ų, 2,6-Ditert-butyl-4-diazoniophenolate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Ditert-butyl-4-diazoniophenolate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,6-Ditert-butyl-4-diazoniophenolate?
The CAS number of 2,6-Ditert-butyl-4-diazoniophenolate is 955-02-2.
What is the molecular formula of 2,6-Ditert-butyl-4-diazoniophenolate?
The molecular formula of 2,6-Ditert-butyl-4-diazoniophenolate is C14H20N2O.
What is the molecular weight of 2,6-Ditert-butyl-4-diazoniophenolate?
The molecular weight of 2,6-Ditert-butyl-4-diazoniophenolate is 232.16 g/mol.
Where can I buy 2,6-Ditert-butyl-4-diazoniophenolate?
You can request a quote for 2,6-Ditert-butyl-4-diazoniophenolate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Ditert-butyl-4-diazoniophenolate?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Ditert-butyl-4-diazoniophenolate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.