3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate
TL;DR: 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate (CAS 30862-33-0) is a chemical compound with molecular formula C11H21NO4 and molecular weight 231.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-butanoyloxy-4-(trimethylazaniumyl)butanoate
Also Known As: Butyrylcarnitine, l-butyrylcarnitine, Butyryl-D-carnitine, O-n-Butyryl-carnitin, 2'-Hydroxychalcon-epoxid
| Molecular Formula | C11H21NO4 |
|---|---|
| Molecular Weight | 231.15 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 231.14706 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 30862-33-0 |
|---|---|
| SMILES | CCCC(=O)O[C@@H](CC(=O)[O-])C[N+](C)(C)C |
| InChIKey | QWYFHHGCZUCMBN-VIFPVBQESA-N |
Product Overview
3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate (CAS 30862-33-0), with molecular formula C11H21NO4 and molecular weight 231.15 g/mol. IUPAC: (3S)-3-butanoyloxy-4-(trimethylazaniumyl)butanoate.
Chemical Property Profile of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate
Property Insights of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate. Following Lipinski's Rule of Five, 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate has 0 hydrogen bond donor(s) and 4 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 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate?
The CAS number of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate is 30862-33-0.
What is the molecular formula of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate?
The molecular formula of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate is C11H21NO4.
What is the molecular weight of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate?
The molecular weight of 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate is 231.15 g/mol.
Where can I buy 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate?
You can request a quote for 3-(Butanoyloxy)-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-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Butanoyloxy)-4-(trimethylazaniumyl)butanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.