Bromoacetylcarnitine
TL;DR: Bromoacetylcarnitine (CAS 7303-39-1) is a chemical compound with molecular formula C9H16BrNO4 and molecular weight 281.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-bromoacetyl)oxy-4-(trimethylazaniumyl)butanoate
Also Known As: Bromoacetylcarnitine, Carnitine bromoacetate, 3-(2-bromoacetyl)oxy-4-(trimethylazaniumyl)butanoate, 3-(2-Bromoacetoxy)-4-(trimethylammonio)butanoate, 3-(2-bromoacetyl)oxy-4-trimethylazaniumylbutanoate
| Molecular Formula | C9H16BrNO4 |
|---|---|
| Molecular Weight | 281.03 g/mol |
| LogP | -0.8607 |
| Topological Polar Surface Area | 66.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 281.02628 |
| Heavy Atoms | 15 |
| Complexity | 236.75706 |
Chemical Identifiers
| CAS Number | 7303-39-1 |
|---|---|
| SMILES | C[N+](C)(C)CC(CC(=O)[O-])OC(=O)CBr |
Product Overview
Bromoacetylcarnitine (CAS 7303-39-1), with molecular formula C9H16BrNO4 and molecular weight 281.03 g/mol. IUPAC: 3-(2-bromoacetyl)oxy-4-(trimethylazaniumyl)butanoate.
Chemical Property Profile of Bromoacetylcarnitine
Property Insights of Bromoacetylcarnitine
The XLogP value of -0.8607 indicates that Bromoacetylcarnitine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 66.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Bromoacetylcarnitine. Following Lipinski's Rule of Five, Bromoacetylcarnitine 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 Bromoacetylcarnitine?
The CAS number of Bromoacetylcarnitine is 7303-39-1.
What is the molecular formula of Bromoacetylcarnitine?
The molecular formula of Bromoacetylcarnitine is C9H16BrNO4.
What is the molecular weight of Bromoacetylcarnitine?
The molecular weight of Bromoacetylcarnitine is 281.03 g/mol.
Where can I buy Bromoacetylcarnitine?
You can request a quote for Bromoacetylcarnitine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bromoacetylcarnitine?
Yes, KEHONG BIO provides custom synthesis services for Bromoacetylcarnitine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.