Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride
TL;DR: Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride (CAS 67465-32-1) is a chemical compound with molecular formula C16H24ClNO5 and molecular weight 345.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-ethoxy-3-ethoxycarbonyl-3-(4-methoxyphenyl)-4-oxobutyl]azanium chloride
Also Known As: Diethyl 2-aminoethyl-(p-methoxyphenyl)malonate hydrochloride, MALONIC ACID, (2-AMINOETHYL)(p-METHOXYPHENYL)-, DIETHYL ESTER, HYDROCHLORIDE, [4-Ethoxy-3-ethoxycarbonyl-3-(4-methoxyphenyl)-4-oxobutyl]azaniumchloride, [4-ethoxy-3-ethoxycarbonyl-3-(4-methoxyphenyl)-4-oxobutyl]azanium chloride, Propanedioic acid, (2-aminoethyl)(4-methoxyphenyl)-, diethyl ester, hydrochloride
| Molecular Formula | C16H24ClNO5 |
|---|---|
| Molecular Weight | 345.13 g/mol |
| LogP | -2.3 |
| Topological Polar Surface Area | 89.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 345.1343 |
| Heavy Atoms | 23 |
| Complexity | 346.0 |
Chemical Identifiers
| CAS Number | 67465-32-1 |
|---|---|
| SMILES | CCOC(=O)C(CC[NH3+])(C1=CC=C(C=C1)OC)C(=O)OCC.[Cl-] |
| InChIKey | NDIXNZOYIHXERB-UHFFFAOYSA-N |
Product Overview
Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride (CAS 67465-32-1), with molecular formula C16H24ClNO5 and molecular weight 345.13 g/mol. IUPAC: [4-ethoxy-3-ethoxycarbonyl-3-(4-methoxyphenyl)-4-oxobutyl]azanium chloride.
Chemical Property Profile of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride
Property Insights of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride
The XLogP value of -2.3 indicates that Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride. Following Lipinski's Rule of Five, Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride has 1 hydrogen bond donor(s) and 6 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 Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride?
The CAS number of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride is 67465-32-1.
What is the molecular formula of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride?
The molecular formula of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride is C16H24ClNO5.
What is the molecular weight of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride?
The molecular weight of Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride is 345.13 g/mol.
Where can I buy Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride?
You can request a quote for Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Malonic acid, (2-aminoethyl)(p-methoxyphenyl)-, diethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.