3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate
TL;DR: 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate (CAS 32051-67-5) is a chemical compound with molecular formula C16H33NO2 and molecular weight 271.25 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(diethylamino)propyl 2-ethyl-2-methylhexanoate
Also Known As: 3-(diethylamino)propyl 2-ethyl-2-methylhexanoate, 2-Ethyl-2-methylhexanoicacid3- propylester, 2-Ethyl-2-methylhexanoic acid 3-(diethylamino)propyl ester, Hexanoic acid, 2-ethyl-2-methyl-, 3-(diethylamino)propyl ester, HEXANOIC ACID, 2-ETHYL-2-METHYL-, 3-DIETHYLAMINOPROPYL ESTER
| Molecular Formula | C16H33NO2 |
|---|---|
| Molecular Weight | 271.25 g/mol |
| LogP | 4.4 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 271.25113 |
| Heavy Atoms | 19 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 32051-67-5 |
|---|---|
| SMILES | CCCCC(C)(CC)C(=O)OCCCN(CC)CC |
| InChIKey | ZBXXNADTECFOSF-UHFFFAOYSA-N |
Product Overview
3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate (CAS 32051-67-5), with molecular formula C16H33NO2 and molecular weight 271.25 g/mol. IUPAC: 3-(diethylamino)propyl 2-ethyl-2-methylhexanoate.
Chemical Property Profile of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate
Property Insights of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate
The XLogP value of 4.4 indicates that 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate 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 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate?
The CAS number of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate is 32051-67-5.
What is the molecular formula of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate?
The molecular formula of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate is C16H33NO2.
What is the molecular weight of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate?
The molecular weight of 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate is 271.25 g/mol.
Where can I buy 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate?
You can request a quote for 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(Diethylamino)propyl 2-ethyl-2-methylhexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.