3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate
TL;DR: 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate (CAS 30862-35-2) is a chemical compound with molecular formula C19H37NO4 and molecular weight 343.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-dodecanoyloxy-4-(trimethylazaniumyl)butanoate
Also Known As: Lauroylcarnitine, O-Lauroyl-carnitin, Lauroyl-D(+)-carnitin, (+)-lauroylcarnitine, Lauroylcarnitine, (+)-
| Molecular Formula | C19H37NO4 |
|---|---|
| Molecular Weight | 343.27 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 15 |
| Exact Mass | 343.27225 |
| Heavy Atoms | 24 |
| Complexity | 344.0 |
Chemical Identifiers
| CAS Number | 30862-35-2 |
|---|---|
| SMILES | CCCCCCCCCCCC(=O)O[C@@H](CC(=O)[O-])C[N+](C)(C)C |
| InChIKey | FUJLYHJROOYKRA-KRWDZBQOSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate (CAS 30862-35-2), with molecular formula C19H37NO4 and molecular weight 343.27 g/mol. IUPAC: (3S)-3-dodecanoyloxy-4-(trimethylazaniumyl)butanoate.
Chemical Property Profile of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate
Property Insights of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate
The XLogP value of 5.5 indicates that 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate. Following Lipinski's Rule of Five, 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate?
The CAS number of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate is 30862-35-2.
What is the molecular formula of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate?
The molecular formula of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate is C19H37NO4.
What is the molecular weight of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate?
The molecular weight of 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate is 343.27 g/mol.
Where can I buy 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate?
You can request a quote for 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Dodecanoyloxy)-4-(trimethylazaniumyl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.