1-十二酰吡咯烷-2-甲酸
TL;DR: 1-十二酰吡咯烷-2-甲酸 (CAS 58725-39-6) is a chemical compound with molecular formula C17H31NO3 and molecular weight 297.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-十二酰吡咯烷-2-甲酸
1-dodecanoylpyrrolidine-2-carboxylic acid
Also Known As: N-Dodecanoyl-L-proline, 1-dodecanoylproline, lauroyl proline, n-lauroyl proline, N-DODECANOYL-PROLINE
| Molecular Formula | C17H31NO3 |
|---|---|
| Molecular Weight | 297.23 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 11 |
| Exact Mass | 297.2304 |
| Heavy Atoms | 21 |
| Complexity | 317.0 |
Chemical Identifiers
| CAS Number | 58725-39-6 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)N1CCCC1C(=O)O |
| InChIKey | AJWFQCNUNFFTHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-十二酰吡咯烷-2-甲酸 (CAS 58725-39-6), with molecular formula C17H31NO3 and molecular weight 297.23 g/mol. IUPAC: 1-dodecanoylpyrrolidine-2-carboxylic acid.
Chemical Property Profile of 1-十二酰吡咯烷-2-甲酸
Property Insights of 1-十二酰吡咯烷-2-甲酸
The XLogP value of 5.2 indicates that 1-十二酰吡咯烷-2-甲酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.6 Ų, 1-十二酰吡咯烷-2-甲酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-十二酰吡咯烷-2-甲酸 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 1-十二酰吡咯烷-2-甲酸?
The CAS number of 1-十二酰吡咯烷-2-甲酸 is 58725-39-6.
What is the molecular formula of 1-十二酰吡咯烷-2-甲酸?
The molecular formula of 1-十二酰吡咯烷-2-甲酸 is C17H31NO3.
What is the molecular weight of 1-十二酰吡咯烷-2-甲酸?
The molecular weight of 1-十二酰吡咯烷-2-甲酸 is 297.23 g/mol.
Where can I buy 1-十二酰吡咯烷-2-甲酸?
You can request a quote for 1-十二酰吡咯烷-2-甲酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-十二酰吡咯烷-2-甲酸?
Yes, KEHONG BIO provides custom synthesis services for 1-十二酰吡咯烷-2-甲酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.