1-Phenyl-3,3-dimethyltriazine oxide
TL;DR: 1-Phenyl-3,3-dimethyltriazine oxide (CAS 59477-92-8) is a chemical compound with molecular formula C8H11N3O and molecular weight 165.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(Z)-(dimethylhydrazinylidene)-oxido-phenylazanium
Also Known As: 1-PHENYL-3,3-DIMETHYLTRIAZINE OXIDE, RefChem:233128
| Molecular Formula | C8H11N3O |
|---|---|
| Molecular Weight | 165.09 g/mol |
| LogP | 1.7572 |
| Topological Polar Surface Area | 41.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 165.09021 |
| Heavy Atoms | 12 |
| Complexity | 268.89127 |
Chemical Identifiers
| CAS Number | 59477-92-8 |
|---|---|
| SMILES | CN(C)/N=[N+](/C1=CC=CC=C1)\[O-] |
Product Overview
1-Phenyl-3,3-dimethyltriazine oxide (CAS 59477-92-8), with molecular formula C8H11N3O and molecular weight 165.09 g/mol. IUPAC: (Z)-(dimethylhydrazinylidene)-oxido-phenylazanium.
Chemical Property Profile of 1-Phenyl-3,3-dimethyltriazine oxide
Property Insights of 1-Phenyl-3,3-dimethyltriazine oxide
The XLogP value of 1.7572 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Phenyl-3,3-dimethyltriazine oxide. With a topological polar surface area (TPSA) of 41.67 Ų, 1-Phenyl-3,3-dimethyltriazine oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Phenyl-3,3-dimethyltriazine oxide has 0 hydrogen bond donor(s) and 2 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 1-Phenyl-3,3-dimethyltriazine oxide?
The CAS number of 1-Phenyl-3,3-dimethyltriazine oxide is 59477-92-8.
What is the molecular formula of 1-Phenyl-3,3-dimethyltriazine oxide?
The molecular formula of 1-Phenyl-3,3-dimethyltriazine oxide is C8H11N3O.
What is the molecular weight of 1-Phenyl-3,3-dimethyltriazine oxide?
The molecular weight of 1-Phenyl-3,3-dimethyltriazine oxide is 165.09 g/mol.
Where can I buy 1-Phenyl-3,3-dimethyltriazine oxide?
You can request a quote for 1-Phenyl-3,3-dimethyltriazine oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Phenyl-3,3-dimethyltriazine oxide?
Yes, KEHONG BIO provides custom synthesis services for 1-Phenyl-3,3-dimethyltriazine oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.