N,N-二甲基草氨酸乙酯
TL;DR: N,N-二甲基草氨酸乙酯 (CAS 16703-52-9) 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.
N,N-二甲基草氨酸乙酯
ethyl 2-(dimethylamino)-2-oxoacetate
Also Known As: Ethyl N,N-dimethyloxamate, ethyl 2-(dimethylamino)-2-oxoacetate, N,N-Dimethyl ethyl oxamate, Ethyl NN-dimethyloxamate, Aethyl-Dimethyloxamat
| Molecular Formula | C6H11NO3 |
|---|---|
| Molecular Weight | 145.07 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 145.0739 |
| Heavy Atoms | 10 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 16703-52-9 |
|---|---|
| SMILES | CCOC(=O)C(=O)N(C)C |
| InChIKey | HMALWDVRMHVUAW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N,N-二甲基草氨酸乙酯 (CAS 16703-52-9), with molecular formula C6H11NO3 and molecular weight 145.07 g/mol. IUPAC: ethyl 2-(dimethylamino)-2-oxoacetate.
Chemical Property Profile of N,N-二甲基草氨酸乙酯
Property Insights of N,N-二甲基草氨酸乙酯
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-二甲基草氨酸乙酯. With a topological polar surface area (TPSA) of 46.6 Ų, N,N-二甲基草氨酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-二甲基草氨酸乙酯 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-二甲基草氨酸乙酯?
The CAS number of N,N-二甲基草氨酸乙酯 is 16703-52-9.
What is the molecular formula of N,N-二甲基草氨酸乙酯?
The molecular formula of N,N-二甲基草氨酸乙酯 is C6H11NO3.
What is the molecular weight of N,N-二甲基草氨酸乙酯?
The molecular weight of N,N-二甲基草氨酸乙酯 is 145.07 g/mol.
Where can I buy N,N-二甲基草氨酸乙酯?
You can request a quote for N,N-二甲基草氨酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-二甲基草氨酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for N,N-二甲基草氨酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.