2-(Pyrrolidin-1-yl)butanedioic acid
TL;DR: 2-(Pyrrolidin-1-yl)butanedioic acid (CAS 5872-56-0) is a chemical compound with molecular formula C8H13NO4 and molecular weight 187.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyrrolidin-1-ylbutanedioic acid
Also Known As: DL-1-Pyrrolidinesuccinic acid, 1-Pyrrolidinesuccinic acid, DL-, 2-pyrrolidin-1-ylbutanedioic acid, 2-(Pyrrolidin-1-yl)butanedioic acid, 2-(pyrrolidin-1-yl)succinic acid
| Molecular Formula | C8H13NO4 |
|---|---|
| Molecular Weight | 187.08 g/mol |
| LogP | -2.4 |
| Topological Polar Surface Area | 77.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 187.08446 |
| Heavy Atoms | 13 |
| Complexity | 210.0 |
Chemical Identifiers
| CAS Number | 5872-56-0 |
|---|---|
| SMILES | C1CCN(C1)C(CC(=O)O)C(=O)O |
| InChIKey | GWYJLFWOAHSKMB-UHFFFAOYSA-N |
Product Overview
2-(Pyrrolidin-1-yl)butanedioic acid (CAS 5872-56-0), with molecular formula C8H13NO4 and molecular weight 187.08 g/mol. IUPAC: 2-pyrrolidin-1-ylbutanedioic acid.
Chemical Property Profile of 2-(Pyrrolidin-1-yl)butanedioic acid
Property Insights of 2-(Pyrrolidin-1-yl)butanedioic acid
The XLogP value of -2.4 indicates that 2-(Pyrrolidin-1-yl)butanedioic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 77.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Pyrrolidin-1-yl)butanedioic acid. Following Lipinski's Rule of Five, 2-(Pyrrolidin-1-yl)butanedioic acid has 2 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 2-(Pyrrolidin-1-yl)butanedioic acid?
The CAS number of 2-(Pyrrolidin-1-yl)butanedioic acid is 5872-56-0.
What is the molecular formula of 2-(Pyrrolidin-1-yl)butanedioic acid?
The molecular formula of 2-(Pyrrolidin-1-yl)butanedioic acid is C8H13NO4.
What is the molecular weight of 2-(Pyrrolidin-1-yl)butanedioic acid?
The molecular weight of 2-(Pyrrolidin-1-yl)butanedioic acid is 187.08 g/mol.
Where can I buy 2-(Pyrrolidin-1-yl)butanedioic acid?
You can request a quote for 2-(Pyrrolidin-1-yl)butanedioic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Pyrrolidin-1-yl)butanedioic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Pyrrolidin-1-yl)butanedioic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.