![2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile structure](/static/products/6770/677024-50-9.webp)
2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile
TL;DR: 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile (CAS 677024-50-9) is a chemical compound with molecular formula C15H13NO2 and molecular weight 239.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[4-(hydroxymethyl)phenoxy]methyl]benzonitrile
Also Known As: 2-{[4-(hydroxymethyl)phenoxy]methyl}benzonitrile, 2-[[4-(hydroxymethyl)phenoxy]methyl]benzonitrile
| Molecular Formula | C15H13NO2 |
|---|---|
| Molecular Weight | 239.09 g/mol |
| LogP | 2.62958 |
| Topological Polar Surface Area | 53.25 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 239.09464 |
| Heavy Atoms | 18 |
| Complexity | 555.4514 |
Chemical Identifiers
| CAS Number | 677024-50-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)COC2=CC=C(C=C2)CO)C#N |
Product Overview
2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile (CAS 677024-50-9), with molecular formula C15H13NO2 and molecular weight 239.09 g/mol. IUPAC: 2-[[4-(hydroxymethyl)phenoxy]methyl]benzonitrile.
Chemical Property Profile of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile
Property Insights of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile
The XLogP value of 2.62958 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile. With a topological polar surface area (TPSA) of 53.25 Ų, 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[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-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile?
The CAS number of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile is 677024-50-9.
What is the molecular formula of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile?
The molecular formula of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile is C15H13NO2.
What is the molecular weight of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile?
The molecular weight of 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile is 239.09 g/mol.
Where can I buy 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile?
You can request a quote for 2-{[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-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-{[4-(Hydroxymethyl)phenoxy]methyl}benzonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.