Methyl 5-amino-4-oxovalerate hydrochloride
TL;DR: Methyl 5-amino-4-oxovalerate hydrochloride (CAS 79416-27-6) is a chemical compound with molecular formula C6H12ClNO3 and molecular weight 181.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methoxy-2,5-dioxopentyl)azanium chloride
Also Known As: Metvixia, Metvix PDT, Methyl aminolevulinate HCl, methyl 5-aminolevulinate HCl, Methyl aminolevulinate hydrochloride
| Molecular Formula | C6H12ClNO3 |
|---|---|
| Molecular Weight | 181.05 g/mol |
| LogP | -4.2454 |
| Topological Polar Surface Area | 71.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.05057 |
| Heavy Atoms | 11 |
| Complexity | 121.789085 |
Chemical Identifiers
| CAS Number | 79416-27-6 |
|---|---|
| SMILES | COC(=O)CCC(=O)C[NH3+].[Cl-] |
Product Overview
Methyl 5-amino-4-oxovalerate hydrochloride (CAS 79416-27-6), with molecular formula C6H12ClNO3 and molecular weight 181.05 g/mol. IUPAC: (5-methoxy-2,5-dioxopentyl)azanium chloride.
Chemical Property Profile of Methyl 5-amino-4-oxovalerate hydrochloride
Property Insights of Methyl 5-amino-4-oxovalerate hydrochloride
The XLogP value of -4.2454 indicates that Methyl 5-amino-4-oxovalerate hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 71.01 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 5-amino-4-oxovalerate hydrochloride. Following Lipinski's Rule of Five, Methyl 5-amino-4-oxovalerate hydrochloride has 1 hydrogen bond donor(s) and 3 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 Methyl 5-amino-4-oxovalerate hydrochloride?
The CAS number of Methyl 5-amino-4-oxovalerate hydrochloride is 79416-27-6.
What is the molecular formula of Methyl 5-amino-4-oxovalerate hydrochloride?
The molecular formula of Methyl 5-amino-4-oxovalerate hydrochloride is C6H12ClNO3.
What is the molecular weight of Methyl 5-amino-4-oxovalerate hydrochloride?
The molecular weight of Methyl 5-amino-4-oxovalerate hydrochloride is 181.05 g/mol.
Where can I buy Methyl 5-amino-4-oxovalerate hydrochloride?
You can request a quote for Methyl 5-amino-4-oxovalerate hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 5-amino-4-oxovalerate hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Methyl 5-amino-4-oxovalerate hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.