1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester
TL;DR: 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester (CAS 137616-72-9) is a chemical compound with molecular formula C12H13NO4 and molecular weight 235.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methoxyphenyl) 2-oxopyrrolidine-1-carboxylate
Also Known As: (2-methoxyphenyl) 2-oxopyrrolidine-1-carboxylate, 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester, 1-(2'-Methoxyphenoxycarbonyl)-2-pyrrolidinone, 2-METHOXYPHENYL 2-OXOPYRROLIDINE-1-CARBOXYLATE, 1-Pyrrolidinecarboxylic acid,2-oxo-,2-methoxyphenyl ester
| Molecular Formula | C12H13NO4 |
|---|---|
| Molecular Weight | 235.08 g/mol |
| LogP | 1.8164 |
| Topological Polar Surface Area | 55.84 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 235.08446 |
| Heavy Atoms | 17 |
| Complexity | 443.8867 |
Chemical Identifiers
| CAS Number | 137616-72-9 |
|---|---|
| SMILES | COC1=CC=CC=C1OC(=O)N2CCCC2=O |
Product Overview
1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester (CAS 137616-72-9), with molecular formula C12H13NO4 and molecular weight 235.08 g/mol. IUPAC: (2-methoxyphenyl) 2-oxopyrrolidine-1-carboxylate.
Chemical Property Profile of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester
Property Insights of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester
The XLogP value of 1.8164 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester. With a topological polar surface area (TPSA) of 55.84 Ų, 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester 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 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester?
The CAS number of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester is 137616-72-9.
What is the molecular formula of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester?
The molecular formula of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester is C12H13NO4.
What is the molecular weight of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester?
The molecular weight of 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester is 235.08 g/mol.
Where can I buy 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester?
You can request a quote for 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidinecarboxylic acid, 2-oxo-, 2-methoxyphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.