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1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid
TL;DR: 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid (CAS 56014-48-3) is a chemical compound with molecular formula C15H21NO4 and molecular weight 279.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid
Also Known As: 1-[2-(3,4-Dimethoxyphenyl)ethyl]proline, 1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid
| Molecular Formula | C15H21NO4 |
|---|---|
| Molecular Weight | 279.15 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 59.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.14706 |
| Heavy Atoms | 20 |
| Complexity | 323.0 |
Chemical Identifiers
| CAS Number | 56014-48-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)CCN2CCCC2C(=O)O)OC |
| InChIKey | UTGMDFFFWYTUBS-UHFFFAOYSA-N |
Product Overview
1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid (CAS 56014-48-3), with molecular formula C15H21NO4 and molecular weight 279.15 g/mol. IUPAC: 1-[2-(3,4-dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid
Property Insights of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid. With a topological polar surface area (TPSA) of 59.0 Ų, 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid has 1 hydrogen bond donor(s) and 5 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-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid?
The CAS number of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid is 56014-48-3.
What is the molecular formula of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid?
The molecular formula of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid is C15H21NO4.
What is the molecular weight of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid?
The molecular weight of 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid is 279.15 g/mol.
Where can I buy 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid?
You can request a quote for 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(3,4-Dimethoxyphenyl)ethyl]pyrrolidine-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.