Malonic acid, ethyl(piperidinomethyl)-, diethyl ester
TL;DR: Malonic acid, ethyl(piperidinomethyl)-, diethyl ester (CAS 92793-35-6) is a chemical compound with molecular formula C15H27NO4 and molecular weight 285.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2-(1-piperidin-1-ylpropan-2-yl)propanedioate
Also Known As: Sch 3701, Etil piperidinometil malonato dietilico, Ethyl(piperidinomethyl)malonic acid diethyl ester, Etil piperidinometil malonato dietilico [Italian], 5-20-03-00099 (Beilstein Handbook Reference)
| Molecular Formula | C15H27NO4 |
|---|---|
| Molecular Weight | 285.19 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 285.194 |
| Heavy Atoms | 20 |
| Complexity | 295.0 |
Chemical Identifiers
| CAS Number | 92793-35-6 |
|---|---|
| SMILES | CCOC(=O)C(C(C)CN1CCCCC1)C(=O)OCC |
| InChIKey | MJJWFTPLZIOGRM-UHFFFAOYSA-N |
Product Overview
Malonic acid, ethyl(piperidinomethyl)-, diethyl ester (CAS 92793-35-6), with molecular formula C15H27NO4 and molecular weight 285.19 g/mol. IUPAC: diethyl 2-(1-piperidin-1-ylpropan-2-yl)propanedioate.
Chemical Property Profile of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester
Property Insights of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Malonic acid, ethyl(piperidinomethyl)-, diethyl ester. With a topological polar surface area (TPSA) of 55.8 Ų, Malonic acid, ethyl(piperidinomethyl)-, diethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Malonic acid, ethyl(piperidinomethyl)-, diethyl ester has 0 hydrogen bond donor(s) and 5 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, ethyl(piperidinomethyl)-, diethyl ester?
The CAS number of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester is 92793-35-6.
What is the molecular formula of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester?
The molecular formula of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester is C15H27NO4.
What is the molecular weight of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester?
The molecular weight of Malonic acid, ethyl(piperidinomethyl)-, diethyl ester is 285.19 g/mol.
Where can I buy Malonic acid, ethyl(piperidinomethyl)-, diethyl ester?
You can request a quote for Malonic acid, ethyl(piperidinomethyl)-, diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Malonic acid, ethyl(piperidinomethyl)-, diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Malonic acid, ethyl(piperidinomethyl)-, diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.