1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid
TL;DR: 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid (CAS 94108-41-5) is a chemical compound with molecular formula C23H41NO3 and molecular weight 379.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-octadec-9-enyl-5-oxopyrrolidine-3-carboxylic acid
Also Known As: 1-(Octadec-9-enyl)-5-oxopyrrolidine-3-carboxylic acid, 1-octadec-9-enyl-5-oxopyrrolidine-3-carboxylic acid, 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid, 3-Pyrrolidinecarboxylicacid, 1-(9-octadecen-1-yl)-5-oxo-, 3-Pyrrolidinecarboxylicacid, 1-(9Z)-9-octadecen-1-yl-5-oxo-
| Molecular Formula | C23H41NO3 |
|---|---|
| Molecular Weight | 379.31 g/mol |
| LogP | 6.9 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 17 |
| Exact Mass | 379.30865 |
| Heavy Atoms | 27 |
| Complexity | 433.0 |
Chemical Identifiers
| CAS Number | 94108-41-5 |
|---|---|
| SMILES | CCCCCCCCC=CCCCCCCCCN1CC(CC1=O)C(=O)O |
| InChIKey | OLRBXRSNJFXWTD-UHFFFAOYSA-N |
Product Overview
1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid (CAS 94108-41-5), with molecular formula C23H41NO3 and molecular weight 379.31 g/mol. IUPAC: 1-octadec-9-enyl-5-oxopyrrolidine-3-carboxylic acid.
Chemical Property Profile of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid
Property Insights of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid
The XLogP value of 6.9 indicates that 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid?
The CAS number of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid is 94108-41-5.
What is the molecular formula of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid?
The molecular formula of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid is C23H41NO3.
What is the molecular weight of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid?
The molecular weight of 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid is 379.31 g/mol.
Where can I buy 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid?
You can request a quote for 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-(9-Octadecen-1-yl)-5-oxo-3-pyrrolidinecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.