![2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile structure](/static/products/677/677015-25-7.png)
2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile
TL;DR: 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile (CAS 677015-25-7) is a chemical compound with molecular formula C15H11BrClNO2 and molecular weight 350.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile
Also Known As: 2-[[2-bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile, 2-{[2-bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl}benzonitrile
| Molecular Formula | C15H11BrClNO2 |
|---|---|
| Molecular Weight | 350.97 g/mol |
| LogP | 4.04548 |
| Topological Polar Surface Area | 53.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 350.96616 |
| Heavy Atoms | 20 |
| Complexity | 644.15845 |
Chemical Identifiers
| CAS Number | 677015-25-7 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC2=C(C=C(C=C2Br)CO)Cl)C#N |
Product Overview
2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile (CAS 677015-25-7), with molecular formula C15H11BrClNO2 and molecular weight 350.97 g/mol. IUPAC: 2-[[2-bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile.
Chemical Property Profile of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile
Property Insights of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile
The XLogP value of 4.04548 indicates that 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.25 Ų, 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile has 1 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-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile?
The CAS number of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile is 677015-25-7.
What is the molecular formula of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile?
The molecular formula of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile is C15H11BrClNO2.
What is the molecular weight of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile?
The molecular weight of 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile is 350.97 g/mol.
Where can I buy 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile?
You can request a quote for 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-Bromo-6-chloro-4-(hydroxymethyl)phenoxy]methyl]benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.