1-Pyrroline-4-hydroxy-2-carboxylate
TL;DR: 1-Pyrroline-4-hydroxy-2-carboxylate (CAS 9054-77-7) is a chemical compound with molecular formula C5H7NO3 and molecular weight 129.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid
Also Known As: 1-Pyrroline-4-hydroxy-2-carboxylate, 3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid, 4-hydroxy-1-pyrroline-2-carboxylic acid, 4-hydroxy-1-pyrroline-2-carboxylate, J2.361.836B
| Molecular Formula | C5H7NO3 |
|---|---|
| Molecular Weight | 129.04 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 69.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 129.04259 |
| Heavy Atoms | 9 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 9054-77-7 |
|---|---|
| SMILES | C1C(CN=C1C(=O)O)O |
| InChIKey | AOMLMYXPXUTBQH-UHFFFAOYSA-N |
Product Overview
1-Pyrroline-4-hydroxy-2-carboxylate (CAS 9054-77-7), with molecular formula C5H7NO3 and molecular weight 129.04 g/mol. IUPAC: 3-hydroxy-3,4-dihydro-2H-pyrrole-5-carboxylic acid.
Chemical Property Profile of 1-Pyrroline-4-hydroxy-2-carboxylate
Property Insights of 1-Pyrroline-4-hydroxy-2-carboxylate
The XLogP value of -1.3 indicates that 1-Pyrroline-4-hydroxy-2-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Pyrroline-4-hydroxy-2-carboxylate. Following Lipinski's Rule of Five, 1-Pyrroline-4-hydroxy-2-carboxylate has 2 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-Pyrroline-4-hydroxy-2-carboxylate?
The CAS number of 1-Pyrroline-4-hydroxy-2-carboxylate is 9054-77-7.
What is the molecular formula of 1-Pyrroline-4-hydroxy-2-carboxylate?
The molecular formula of 1-Pyrroline-4-hydroxy-2-carboxylate is C5H7NO3.
What is the molecular weight of 1-Pyrroline-4-hydroxy-2-carboxylate?
The molecular weight of 1-Pyrroline-4-hydroxy-2-carboxylate is 129.04 g/mol.
Where can I buy 1-Pyrroline-4-hydroxy-2-carboxylate?
You can request a quote for 1-Pyrroline-4-hydroxy-2-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrroline-4-hydroxy-2-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrroline-4-hydroxy-2-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.