Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate
TL;DR: Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate (CAS 98992-14-4) is a chemical compound with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[cyano-(3-phenoxyphenyl)methyl] N,N-dimethylcarbamate
Also Known As: Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate, cyano(3-phenoxyphenyl)methyl dimethylcarbamate, [cyano-(3-phenoxyphenyl)methyl] N,N-dimethylcarbamate, Carbamic acid, N,N-dimethyl-, cyano(3-phenoxyphenyl)methyl ester, Carbamuc acud, N,N-dimethyl-, cyano(3-phenoxyphenyl)methyl ester
| Molecular Formula | C17H16N2O3 |
|---|---|
| Molecular Weight | 296.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 296.1161 |
| Heavy Atoms | 22 |
| Complexity | 409.0 |
Chemical Identifiers
| CAS Number | 98992-14-4 |
|---|---|
| SMILES | CN(C)C(=O)OC(C#N)C1=CC(=CC=C1)OC2=CC=CC=C2 |
| InChIKey | UBCGKNUUWDOFMM-UHFFFAOYSA-N |
Product Overview
Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate (CAS 98992-14-4), with molecular formula C17H16N2O3 and molecular weight 296.12 g/mol. IUPAC: [cyano-(3-phenoxyphenyl)methyl] N,N-dimethylcarbamate.
Chemical Property Profile of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate
Property Insights of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate
The XLogP value of 3.6 indicates that Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate. Following Lipinski's Rule of Five, Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate has 0 hydrogen bond donor(s) and 4 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 Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate?
The CAS number of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate is 98992-14-4.
What is the molecular formula of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate?
The molecular formula of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate is C17H16N2O3.
What is the molecular weight of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate?
The molecular weight of Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate is 296.12 g/mol.
Where can I buy Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate?
You can request a quote for Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Cyano(3-phenoxyphenyl)methyl N,N-dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.