Isovalerylcarnitine
TL;DR: Isovalerylcarnitine (CAS 35841-67-9) is a chemical compound with molecular formula C12H23NO4 and molecular weight 245.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate
Also Known As: Isovalerylcarnitine, isovaleryl-l-carnitine, 3-Methylbutyrylcarnitine, Isovaleryl L-carnitine, C5IsovalerylL-Carnitine
| Molecular Formula | C12H23NO4 |
|---|---|
| Molecular Weight | 245.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 245.1627 |
| Heavy Atoms | 17 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 35841-67-9 |
|---|---|
| SMILES | CC(C)CC(=O)O[C@H](CC(=O)[O-])C[N+](C)(C)C |
| InChIKey | IGQBPDJNUXPEMT-SNVBAGLBSA-N |
Product Overview
Isovalerylcarnitine (CAS 35841-67-9), with molecular formula C12H23NO4 and molecular weight 245.16 g/mol. IUPAC: (3R)-3-(3-methylbutanoyloxy)-4-(trimethylazaniumyl)butanoate.
Chemical Property Profile of Isovalerylcarnitine
Property Insights of Isovalerylcarnitine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isovalerylcarnitine. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Isovalerylcarnitine. Following Lipinski's Rule of Five, Isovalerylcarnitine 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 Isovalerylcarnitine?
The CAS number of Isovalerylcarnitine is 35841-67-9.
What is the molecular formula of Isovalerylcarnitine?
The molecular formula of Isovalerylcarnitine is C12H23NO4.
What is the molecular weight of Isovalerylcarnitine?
The molecular weight of Isovalerylcarnitine is 245.16 g/mol.
Where can I buy Isovalerylcarnitine?
You can request a quote for Isovalerylcarnitine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isovalerylcarnitine?
Yes, KEHONG BIO provides custom synthesis services for Isovalerylcarnitine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.