Propyl 5-(diethylamino)-5-oxopentanoate
TL;DR: Propyl 5-(diethylamino)-5-oxopentanoate (CAS 84235-46-1) is a chemical compound with molecular formula C12H23NO3 and molecular weight 229.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
propyl 5-(diethylamino)-5-oxopentanoate
Also Known As: propyl 5-(diethylamino)-5-oxopentanoate, ethyl 4-(dipropan-2-ylamino)-4-oxobutanoate, Pentanoic acid, 5-(diethylamino)-5-oxo-,propyl ester
| Molecular Formula | C12H23NO3 |
|---|---|
| Molecular Weight | 229.17 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 46.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 9 |
| Exact Mass | 229.1678 |
| Heavy Atoms | 16 |
| Complexity | 212.0 |
Chemical Identifiers
| CAS Number | 84235-46-1 |
|---|---|
| SMILES | CCCOC(=O)CCCC(=O)N(CC)CC |
| InChIKey | GXNKTYKMAVSEIN-UHFFFAOYSA-N |
Product Overview
Propyl 5-(diethylamino)-5-oxopentanoate (CAS 84235-46-1), with molecular formula C12H23NO3 and molecular weight 229.17 g/mol. IUPAC: propyl 5-(diethylamino)-5-oxopentanoate.
Chemical Property Profile of Propyl 5-(diethylamino)-5-oxopentanoate
Property Insights of Propyl 5-(diethylamino)-5-oxopentanoate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propyl 5-(diethylamino)-5-oxopentanoate. With a topological polar surface area (TPSA) of 46.6 Ų, Propyl 5-(diethylamino)-5-oxopentanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propyl 5-(diethylamino)-5-oxopentanoate 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 Propyl 5-(diethylamino)-5-oxopentanoate?
The CAS number of Propyl 5-(diethylamino)-5-oxopentanoate is 84235-46-1.
What is the molecular formula of Propyl 5-(diethylamino)-5-oxopentanoate?
The molecular formula of Propyl 5-(diethylamino)-5-oxopentanoate is C12H23NO3.
What is the molecular weight of Propyl 5-(diethylamino)-5-oxopentanoate?
The molecular weight of Propyl 5-(diethylamino)-5-oxopentanoate is 229.17 g/mol.
Where can I buy Propyl 5-(diethylamino)-5-oxopentanoate?
You can request a quote for Propyl 5-(diethylamino)-5-oxopentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propyl 5-(diethylamino)-5-oxopentanoate?
Yes, KEHONG BIO provides custom synthesis services for Propyl 5-(diethylamino)-5-oxopentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.