5-(F-Octyl)-pentanoyl carnitine
TL;DR: 5-(F-Octyl)-pentanoyl carnitine (CAS 142674-36-0) is a chemical compound with molecular formula C20H22F17NO4 and molecular weight 663.12775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecanoyloxy)-4-(trimethylazaniumyl)butanoate
Also Known As: 5-(F-Octyl)-pentanoyl carnitine, 1-Propanaminium, 3-carboxy-2-((6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluoro-1-oxotridecyl)oxy)-N,N,N-trimethyl-, hydroxide, inner salt (+-)-, 3-[(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-Heptadecafluorotridecanoyl)oxy]-4-(trimethylazaniumyl)butanoate, 3-(6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,13-heptadecafluorotridecanoyloxy)-4-(trimethylazaniumyl)butanoate, BRN 4898715
Technical Specifications
| Molecular Formula | C20H22F17NO4 |
| Molecular Weight | 663.12775 g/mol |
| XLogP | 7.2 |
| Topological Polar Surface Area (TPSA) | 66.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 16 |
| Exact Mass | 663.12775 Da |
| Heavy Atoms | 42 |
| Complexity | 952.0 |
| SMILES | C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CCCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F |
| InChIKey | REJPMZDEYKRFJA-UHFFFAOYSA-N |
Chemical Property Profile of 5-(F-Octyl)-pentanoyl carnitine
Property Insights of 5-(F-Octyl)-pentanoyl carnitine
The XLogP value of 7.2 indicates that 5-(F-Octyl)-pentanoyl carnitine 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 5-(F-Octyl)-pentanoyl carnitine. Following Lipinski's Rule of Five, 5-(F-Octyl)-pentanoyl carnitine has 0 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 5-(F-Octyl)-pentanoyl carnitine?
The CAS number of 5-(F-Octyl)-pentanoyl carnitine is 142674-36-0.
What is the molecular formula of 5-(F-Octyl)-pentanoyl carnitine?
The molecular formula of 5-(F-Octyl)-pentanoyl carnitine is C20H22F17NO4.
What is the molecular weight of 5-(F-Octyl)-pentanoyl carnitine?
The molecular weight of 5-(F-Octyl)-pentanoyl carnitine is 663.12775 g/mol.
Where can I buy 5-(F-Octyl)-pentanoyl carnitine?
You can request a quote for 5-(F-Octyl)-pentanoyl carnitine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-(F-Octyl)-pentanoyl carnitine?
Yes, CoreyChem provides custom synthesis services for 5-(F-Octyl)-pentanoyl carnitine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.