m-Phenoxybenzyl cyanide
TL;DR: m-Phenoxybenzyl cyanide (CAS 51632-29-2) is a chemical compound with molecular formula C14H11NO and molecular weight 209.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-phenoxyphenyl)acetonitrile
Also Known As: 3-Phenoxyphenylacetonitrile, 2-(3-phenoxyphenyl)acetonitrile, 3-Phenoxybenzyl cyanide, m-Phenoxybenzyl cyanide, (3-Phenoxyphenyl)acetonitrile
| Molecular Formula | C14H11NO |
|---|---|
| Molecular Weight | 209.08 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 33.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.08406 |
| Heavy Atoms | 16 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 51632-29-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)CC#N |
| InChIKey | DKGMALJGFUHPGB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 17 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
m-Phenoxybenzyl cyanide (CAS 51632-29-2), with molecular formula C14H11NO and molecular weight 209.08 g/mol. IUPAC: 2-(3-phenoxyphenyl)acetonitrile.
Chemical Property Profile of m-Phenoxybenzyl cyanide
Property Insights of m-Phenoxybenzyl cyanide
The XLogP value of 3.0 indicates that m-Phenoxybenzyl cyanide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.0 Ų, m-Phenoxybenzyl cyanide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, m-Phenoxybenzyl cyanide has 0 hydrogen bond donor(s) and 2 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 m-Phenoxybenzyl cyanide?
The CAS number of m-Phenoxybenzyl cyanide is 51632-29-2.
What is the molecular formula of m-Phenoxybenzyl cyanide?
The molecular formula of m-Phenoxybenzyl cyanide is C14H11NO.
What is the molecular weight of m-Phenoxybenzyl cyanide?
The molecular weight of m-Phenoxybenzyl cyanide is 209.08 g/mol.
Where can I buy m-Phenoxybenzyl cyanide?
You can request a quote for m-Phenoxybenzyl cyanide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for m-Phenoxybenzyl cyanide?
Yes, KEHONG BIO provides custom synthesis services for m-Phenoxybenzyl cyanide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.