2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate
TL;DR: 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate (CAS 14377-29-8) is a chemical compound with molecular formula C21H35NO2 and molecular weight 333.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 3,5-ditert-butylbenzoate
Also Known As: 2-(diethylamino)ethyl 3,5-ditert-butylbenzoate, 2-(diethylamino)ethyl 3,5-di-tert-butylbenzoate, 2-diethylaminoethyl 3,5-ditert-butylbenzoate, AO-365/41272976
| Molecular Formula | C21H35NO2 |
|---|---|
| Molecular Weight | 333.27 g/mol |
| LogP | 4.7802 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 333.26678 |
| Heavy Atoms | 24 |
| Complexity | 513.6877 |
Chemical Identifiers
| CAS Number | 14377-29-8 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC(=CC(=C1)C(C)(C)C)C(C)(C)C |
Product Overview
2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate (CAS 14377-29-8), with molecular formula C21H35NO2 and molecular weight 333.27 g/mol. IUPAC: 2-(diethylamino)ethyl 3,5-ditert-butylbenzoate.
Chemical Property Profile of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate
Property Insights of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate
The XLogP value of 4.7802 indicates that 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate 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 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate?
The CAS number of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate is 14377-29-8.
What is the molecular formula of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate?
The molecular formula of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate is C21H35NO2.
What is the molecular weight of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate?
The molecular weight of 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate is 333.27 g/mol.
Where can I buy 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate?
You can request a quote for 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Diethylamino)ethyl 3,5-ditert-butylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.