2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile
TL;DR: 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile (CAS 693228-64-7) is a chemical compound with molecular formula C14H11BrN2O and molecular weight 302.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-bromophenoxy)-4,6-dimethylpyridine-3-carbonitrile
Also Known As: 2-(2-bromophenoxy)-4,6-dimethylnicotinonitrile, 2-(2-Bromophenoxy)-4,6-dimethyl-3-pyridinecarbonitrile, 2-(2-bromophenoxy)-4,6-dimethylpyridine-3-carbonitrile
| Molecular Formula | C14H11BrN2O |
|---|---|
| Molecular Weight | 302.01 g/mol |
| LogP | 4.12492 |
| Topological Polar Surface Area | 45.91 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.0055 |
| Heavy Atoms | 18 |
| Complexity | 632.1765 |
Chemical Identifiers
| CAS Number | 693228-64-7 |
|---|---|
| SMILES | CC1=CC(=NC(=C1C#N)OC2=CC=CC=C2Br)C |
Product Overview
2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile (CAS 693228-64-7), with molecular formula C14H11BrN2O and molecular weight 302.01 g/mol. IUPAC: 2-(2-bromophenoxy)-4,6-dimethylpyridine-3-carbonitrile.
Chemical Property Profile of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile
Property Insights of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile
The XLogP value of 4.12492 indicates that 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.91 Ų, 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile has 0 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 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile?
The CAS number of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile is 693228-64-7.
What is the molecular formula of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile?
The molecular formula of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile is C14H11BrN2O.
What is the molecular weight of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile?
The molecular weight of 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile is 302.01 g/mol.
Where can I buy 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile?
You can request a quote for 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(2-Bromophenoxy)-4,6-dimethylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.