1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester
TL;DR: 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester (CAS 33927-64-9) is a chemical compound with molecular formula C9H15NO3 and molecular weight 185.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(2-methyl-5-oxopyrrolidin-1-yl)acetate
Also Known As: ethyl 2-(2-methyl-5-oxopyrrolidin-1-yl)acetate, ethyl 2-methyl-5-oxo-1-pyrrolidineacetate, Ethyl (2-methyl-5-oxo-1-pyrrolidinyl)acetate, Ethyl (2-methyl-5-oxo-1-pyrrolidinyl)acetate #, ethyl 2-(2-methyl-5-oxo-1-pyrrolidinyl)acetate
| Molecular Formula | C9H15NO3 |
|---|---|
| Molecular Weight | 185.11 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 185.1052 |
| Heavy Atoms | 13 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 33927-64-9 |
|---|---|
| SMILES | CCOC(=O)CN1C(CCC1=O)C |
| InChIKey | GNSMPPFYUNOZQE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester (CAS 33927-64-9), with molecular formula C9H15NO3 and molecular weight 185.11 g/mol. IUPAC: ethyl 2-(2-methyl-5-oxopyrrolidin-1-yl)acetate.
Chemical Property Profile of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester
Property Insights of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester. With a topological polar surface area (TPSA) of 46.6 Ų, 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester 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 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester?
The CAS number of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester is 33927-64-9.
What is the molecular formula of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester?
The molecular formula of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester is C9H15NO3.
What is the molecular weight of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester?
The molecular weight of 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester is 185.11 g/mol.
Where can I buy 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester?
You can request a quote for 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidineacetic acid, 2-methyl-5-oxo-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.