Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)
TL;DR: Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) (CAS 86343-60-4) is a chemical compound with molecular formula C9H20BrNO2 and molecular weight 253.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(diethylamino)-2-methylpropanoate;hydrobromide
Also Known As: 2-((Diethylamino)methyl)propionic acid methyl ester hydrobromide, methyl 3-(diethylamino)-2-methylpropanoate hydrobromide, Propanoic acid, 3-(diethylamino)-2-methyl- methyl ester, hydrobromide, Propionic acid, 2-((diethylamino)methyl)-, methyl ester, hydrobromide, methyl 3-(diethylamino)-2-methylpropanoate,hydrobromide
| Molecular Formula | C9H20BrNO2 |
|---|---|
| Molecular Weight | 253.07 g/mol |
| LogP | 1.7152 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.06773 |
| Heavy Atoms | 13 |
| Complexity | 137.57639 |
Chemical Identifiers
| CAS Number | 86343-60-4 |
|---|---|
| SMILES | CCN(CC)CC(C)C(=O)OC.Br |
Product Overview
Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) (CAS 86343-60-4), with molecular formula C9H20BrNO2 and molecular weight 253.07 g/mol. IUPAC: methyl 3-(diethylamino)-2-methylpropanoate;hydrobromide.
Chemical Property Profile of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)
Property Insights of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)
The XLogP value of 1.7152 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1). With a topological polar surface area (TPSA) of 29.54 Ų, Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) has 0 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 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)?
The CAS number of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) is 86343-60-4.
What is the molecular formula of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)?
The molecular formula of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) is C9H20BrNO2.
What is the molecular weight of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)?
The molecular weight of Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) is 253.07 g/mol.
Where can I buy Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)?
You can request a quote for Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1)?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-(diethylamino)-2-methylpropanoate--hydrogen bromide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.