Acetonitrile, (m-phenoxyphenyl)oxo-
TL;DR: Acetonitrile, (m-phenoxyphenyl)oxo- (CAS 61775-25-5) is a chemical compound with molecular formula C14H9NO2 and molecular weight 223.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenoxybenzoyl cyanide
Also Known As: 3-Phenoxybenzoyl cyanide, oxoacetonitrile, m-Phenoxybenzoyl cyanide, (m-Phenoxyphenyl)oxoacetonitrile, 3-(phenoxy)benzoyl cyanide
| Molecular Formula | C14H9NO2 |
|---|---|
| Molecular Weight | 223.06 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 50.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 223.06332 |
| Heavy Atoms | 17 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 61775-25-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC=CC(=C2)C(=O)C#N |
| InChIKey | RBJUQCDEOCYPBM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Acetonitrile, (m-phenoxyphenyl)oxo- (CAS 61775-25-5), with molecular formula C14H9NO2 and molecular weight 223.06 g/mol. IUPAC: 3-phenoxybenzoyl cyanide.
Chemical Property Profile of Acetonitrile, (m-phenoxyphenyl)oxo-
Property Insights of Acetonitrile, (m-phenoxyphenyl)oxo-
The XLogP value of 4.0 indicates that Acetonitrile, (m-phenoxyphenyl)oxo- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.1 Ų, Acetonitrile, (m-phenoxyphenyl)oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetonitrile, (m-phenoxyphenyl)oxo- 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 Acetonitrile, (m-phenoxyphenyl)oxo-?
The CAS number of Acetonitrile, (m-phenoxyphenyl)oxo- is 61775-25-5.
What is the molecular formula of Acetonitrile, (m-phenoxyphenyl)oxo-?
The molecular formula of Acetonitrile, (m-phenoxyphenyl)oxo- is C14H9NO2.
What is the molecular weight of Acetonitrile, (m-phenoxyphenyl)oxo-?
The molecular weight of Acetonitrile, (m-phenoxyphenyl)oxo- is 223.06 g/mol.
Where can I buy Acetonitrile, (m-phenoxyphenyl)oxo-?
You can request a quote for Acetonitrile, (m-phenoxyphenyl)oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetonitrile, (m-phenoxyphenyl)oxo-?
Yes, KEHONG BIO provides custom synthesis services for Acetonitrile, (m-phenoxyphenyl)oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.