Einecs 259-235-4
TL;DR: Einecs 259-235-4 (CAS 54571-68-5) is a chemical compound with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-dimethylmethanamine;(2S)-5-oxopyrrolidine-2-carboxylic acid
Also Known As: EINECS 259-235-4, 5-Oxo-L-proline, compound with trimethylamine (1:1), 5-Oxo-L-proline--N,N-dimethylmethanamine (1/1), N,N-dimethylmethanamine; (2S)-5-oxopyrrolidine-2-carboxylic acid
| Molecular Formula | C8H16N2O3 |
|---|---|
| Molecular Weight | 188.12 g/mol |
| LogP | -0.4726 |
| Topological Polar Surface Area | 69.64 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 188.11609 |
| Heavy Atoms | 13 |
| Complexity | 189.07327 |
Chemical Identifiers
| CAS Number | 54571-68-5 |
|---|---|
| SMILES | CN(C)C.C1CC(=O)N[C@@H]1C(=O)O |
Product Overview
Einecs 259-235-4 (CAS 54571-68-5), with molecular formula C8H16N2O3 and molecular weight 188.12 g/mol. IUPAC: N,N-dimethylmethanamine;(2S)-5-oxopyrrolidine-2-carboxylic acid.
Chemical Property Profile of Einecs 259-235-4
Property Insights of Einecs 259-235-4
The XLogP value of -0.4726 indicates that Einecs 259-235-4 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.64 Ų falls within the moderate polarity range, balancing permeability and solubility for Einecs 259-235-4. Following Lipinski's Rule of Five, Einecs 259-235-4 has 2 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 Einecs 259-235-4?
The CAS number of Einecs 259-235-4 is 54571-68-5.
What is the molecular formula of Einecs 259-235-4?
The molecular formula of Einecs 259-235-4 is C8H16N2O3.
What is the molecular weight of Einecs 259-235-4?
The molecular weight of Einecs 259-235-4 is 188.12 g/mol.
Where can I buy Einecs 259-235-4?
You can request a quote for Einecs 259-235-4 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Einecs 259-235-4?
Yes, KEHONG BIO provides custom synthesis services for Einecs 259-235-4 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.