N,N-diethyl-2-(4-formylphenoxy)acetamide
TL;DR: N,N-diethyl-2-(4-formylphenoxy)acetamide (CAS 685853-68-3) is a chemical compound with molecular formula C13H17NO3 and molecular weight 235.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethyl-2-(4-formylphenoxy)acetamide
Also Known As: N,N-diethyl-2-(4-formylphenoxy)acetamide, starbld0006926, AURORA 21587, F3099-5009
| Molecular Formula | C13H17NO3 |
|---|---|
| Molecular Weight | 235.12 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 235.12085 |
| Heavy Atoms | 17 |
| Complexity | 243.0 |
Chemical Identifiers
| CAS Number | 685853-68-3 |
|---|---|
| SMILES | CCN(CC)C(=O)COC1=CC=C(C=C1)C=O |
| InChIKey | HVIDYQCYIDTDFR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-diethyl-2-(4-formylphenoxy)acetamide (CAS 685853-68-3), with molecular formula C13H17NO3 and molecular weight 235.12 g/mol. IUPAC: N,N-diethyl-2-(4-formylphenoxy)acetamide.
Chemical Property Profile of N,N-diethyl-2-(4-formylphenoxy)acetamide
Property Insights of N,N-diethyl-2-(4-formylphenoxy)acetamide
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-diethyl-2-(4-formylphenoxy)acetamide. With a topological polar surface area (TPSA) of 46.6 Ų, N,N-diethyl-2-(4-formylphenoxy)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-diethyl-2-(4-formylphenoxy)acetamide 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 N,N-diethyl-2-(4-formylphenoxy)acetamide?
The CAS number of N,N-diethyl-2-(4-formylphenoxy)acetamide is 685853-68-3.
What is the molecular formula of N,N-diethyl-2-(4-formylphenoxy)acetamide?
The molecular formula of N,N-diethyl-2-(4-formylphenoxy)acetamide is C13H17NO3.
What is the molecular weight of N,N-diethyl-2-(4-formylphenoxy)acetamide?
The molecular weight of N,N-diethyl-2-(4-formylphenoxy)acetamide is 235.12 g/mol.
Where can I buy N,N-diethyl-2-(4-formylphenoxy)acetamide?
You can request a quote for N,N-diethyl-2-(4-formylphenoxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-diethyl-2-(4-formylphenoxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for N,N-diethyl-2-(4-formylphenoxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.