Octadecyl 3-(aziridin-1-yl)propanoate
TL;DR: Octadecyl 3-(aziridin-1-yl)propanoate (CAS 58998-66-6) is a chemical compound with molecular formula C23H45NO2 and molecular weight 367.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
octadecyl 3-(aziridin-1-yl)propanoate
Also Known As: octadecyl 3-(aziridin-1-yl)propanoate, 1-Aziridinepropanoic acid,octadecyl ester, 1-Aziridinepropanoic acid, octadecyl ester
| Molecular Formula | C23H45NO2 |
|---|---|
| Molecular Weight | 367.35 g/mol |
| LogP | 8.7 |
| Topological Polar Surface Area | 29.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 21 |
| Exact Mass | 367.34503 |
| Heavy Atoms | 26 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 58998-66-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCCCCOC(=O)CCN1CC1 |
| InChIKey | LBWGGZSEDPQNJD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Octadecyl 3-(aziridin-1-yl)propanoate (CAS 58998-66-6), with molecular formula C23H45NO2 and molecular weight 367.35 g/mol. IUPAC: octadecyl 3-(aziridin-1-yl)propanoate.
Chemical Property Profile of Octadecyl 3-(aziridin-1-yl)propanoate
Property Insights of Octadecyl 3-(aziridin-1-yl)propanoate
The XLogP value of 8.7 indicates that Octadecyl 3-(aziridin-1-yl)propanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.3 Ų, Octadecyl 3-(aziridin-1-yl)propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octadecyl 3-(aziridin-1-yl)propanoate has 0 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 Octadecyl 3-(aziridin-1-yl)propanoate?
The CAS number of Octadecyl 3-(aziridin-1-yl)propanoate is 58998-66-6.
What is the molecular formula of Octadecyl 3-(aziridin-1-yl)propanoate?
The molecular formula of Octadecyl 3-(aziridin-1-yl)propanoate is C23H45NO2.
What is the molecular weight of Octadecyl 3-(aziridin-1-yl)propanoate?
The molecular weight of Octadecyl 3-(aziridin-1-yl)propanoate is 367.35 g/mol.
Where can I buy Octadecyl 3-(aziridin-1-yl)propanoate?
You can request a quote for Octadecyl 3-(aziridin-1-yl)propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octadecyl 3-(aziridin-1-yl)propanoate?
Yes, KEHONG BIO provides custom synthesis services for Octadecyl 3-(aziridin-1-yl)propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.