4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol
TL;DR: 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol (CAS 202828-02-2) is a chemical compound with molecular formula C20H14BrN5O7 and molecular weight 515.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[[5-methyl-2-(2,4,6-trinitroanilino)phenyl]iminomethyl]phenol
Also Known As: 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol, 4-bromo-2-[(E)-({5-methyl-2-[(2,4,6-trinitrophenyl)amino]phenyl}imino)methyl]phenol, (6E)-4-bromo-6-[[5-methyl-2-(2,4,6-trinitroanilino)anilino]methylidene]cyclohexa-2,4-dien-1-one, 4-bromo-6-[[5-methyl-2-(2,4,6-trinitroanilino)anilino]methylidene]cyclohexa-2,4-dien-1-one
| Molecular Formula | C20H14BrN5O7 |
|---|---|
| Molecular Weight | 515.01 g/mol |
| LogP | 5.68192 |
| Topological Polar Surface Area | 174.04 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 515.0077 |
| Heavy Atoms | 33 |
| Complexity | 1291.146 |
Chemical Identifiers
| CAS Number | 202828-02-2 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])N=CC3=C(C=CC(=C3)Br)O |
Product Overview
4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol (CAS 202828-02-2), with molecular formula C20H14BrN5O7 and molecular weight 515.01 g/mol. IUPAC: 4-bromo-2-[[5-methyl-2-(2,4,6-trinitroanilino)phenyl]iminomethyl]phenol.
Chemical Property Profile of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol
Property Insights of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol
The XLogP value of 5.68192 indicates that 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 174.04 Ų indicates high polarity, suggesting 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol?
The CAS number of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol is 202828-02-2.
What is the molecular formula of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol?
The molecular formula of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol is C20H14BrN5O7.
What is the molecular weight of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol?
The molecular weight of 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol is 515.01 g/mol.
Where can I buy 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol?
You can request a quote for 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol?
Yes, KEHONG BIO provides custom synthesis services for 4-bromo-2-(((5-methyl-2-((2,4,6-trinitrophenyl)amino)phenyl)imino)methyl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.