2-乙酰氨基乙基乙酸酯
TL;DR: 2-乙酰氨基乙基乙酸酯 (CAS 16180-96-4) is a chemical compound with molecular formula C6H11NO3 and molecular weight 145.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙酰氨基乙基乙酸酯
2-acetamidoethyl acetate
Also Known As: 2-Acetamidoethyl acetate, 2-(acetylamino)ethyl acetate, Nicorandil Impurity 53, N-acetoxyethylacetamide, Acetamide, N-[2-(acetyloxy)ethyl]-
| Molecular Formula | C6H11NO3 |
|---|---|
| Molecular Weight | 145.07 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 145.0739 |
| Heavy Atoms | 10 |
| Complexity | 133.0 |
Chemical Identifiers
| CAS Number | 16180-96-4 |
|---|---|
| SMILES | CC(=O)NCCOC(=O)C |
| InChIKey | SKPWGBMKZNVXFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙酰氨基乙基乙酸酯 (CAS 16180-96-4), with molecular formula C6H11NO3 and molecular weight 145.07 g/mol. IUPAC: 2-acetamidoethyl acetate.
Chemical Property Profile of 2-乙酰氨基乙基乙酸酯
Property Insights of 2-乙酰氨基乙基乙酸酯
The XLogP value of -0.6 indicates that 2-乙酰氨基乙基乙酸酯 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 55.4 Ų, 2-乙酰氨基乙基乙酸酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-乙酰氨基乙基乙酸酯 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-乙酰氨基乙基乙酸酯?
The CAS number of 2-乙酰氨基乙基乙酸酯 is 16180-96-4.
What is the molecular formula of 2-乙酰氨基乙基乙酸酯?
The molecular formula of 2-乙酰氨基乙基乙酸酯 is C6H11NO3.
What is the molecular weight of 2-乙酰氨基乙基乙酸酯?
The molecular weight of 2-乙酰氨基乙基乙酸酯 is 145.07 g/mol.
Where can I buy 2-乙酰氨基乙基乙酸酯?
You can request a quote for 2-乙酰氨基乙基乙酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙酰氨基乙基乙酸酯?
Yes, KEHONG BIO provides custom synthesis services for 2-乙酰氨基乙基乙酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.