2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol
TL;DR: 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol (CAS 879474-13-2) is a chemical compound with molecular formula C20H19BrN2O3 and molecular weight 414.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl]-5-(2-methylprop-2-enoxy)phenol
Also Known As: 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol, 2-[4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl]-5-[(2-methylallyl)oxy]phenol, 2-[4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl]-5-[(2-methylprop-2-en-1-yl)oxy]phenol, 2-[4-(2-bromophenoxy)-5-methylpyrazol-3-yl]-5-(2-methylprop-2-enyloxy)phenol, (6Z)-6-[4-(2-bromophenoxy)-5-methyl-1,2-dihydropyrazol-3-ylidene]-3-(2-methylprop-2-enoxy)cyclohexa-2,4-dien-1-one
| Molecular Formula | C20H19BrN2O3 |
|---|---|
| Molecular Weight | 414.06 g/mol |
| LogP | 5.60042 |
| Topological Polar Surface Area | 67.37 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 414.05792 |
| Heavy Atoms | 26 |
| Complexity | 949.9794 |
Chemical Identifiers
| CAS Number | 879474-13-2 |
|---|---|
| SMILES | CC1=C(C(=NN1)C2=C(C=C(C=C2)OCC(=C)C)O)OC3=CC=CC=C3Br |
Product Overview
2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol (CAS 879474-13-2), with molecular formula C20H19BrN2O3 and molecular weight 414.06 g/mol. IUPAC: 2-[4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl]-5-(2-methylprop-2-enoxy)phenol.
Chemical Property Profile of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol
Property Insights of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol
The XLogP value of 5.60042 indicates that 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.37 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol. Following Lipinski's Rule of Five, 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol?
The CAS number of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol is 879474-13-2.
What is the molecular formula of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol?
The molecular formula of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol is C20H19BrN2O3.
What is the molecular weight of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol?
The molecular weight of 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol is 414.06 g/mol.
Where can I buy 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol?
You can request a quote for 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-(2-bromophenoxy)-5-methyl-1H-pyrazol-3-yl)-5-((2-methylallyl)oxy)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.