Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride
TL;DR: Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride (CAS 100311-36-2) is a chemical compound with molecular formula C19H32ClNO3 and molecular weight 357.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-carboxy-2,6-dipropylphenoxy)ethyl-diethylazanium chloride
Also Known As: 4-(2-(Diethylamino)ethoxy)-3,5-dipropylbenzoic acid hydrochloride, 2-(4-carboxy-2,6-dipropylphenoxy)ethyl-diethylazanium chloride, BENZOIC ACID, 4-(2-(DIETHYLAMINO)ETHOXY)-3,5-DIPROPYL-, HYDROCHLORIDE, 2-(4-carboxy-2,6-dipropylphenoxy)ethyl-diethylazanium, RefChem:327407
| Molecular Formula | C19H32ClNO3 |
|---|---|
| Molecular Weight | 357.21 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 51.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 357.20706 |
| Heavy Atoms | 24 |
| Complexity | 315.0 |
Chemical Identifiers
| CAS Number | 100311-36-2 |
|---|---|
| SMILES | CCCC1=CC(=CC(=C1OCC[NH+](CC)CC)CCC)C(=O)O.[Cl-] |
| InChIKey | ALOYRRXNZFTOSZ-UHFFFAOYSA-N |
Product Overview
Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride (CAS 100311-36-2), with molecular formula C19H32ClNO3 and molecular weight 357.21 g/mol. IUPAC: 2-(4-carboxy-2,6-dipropylphenoxy)ethyl-diethylazanium chloride.
Chemical Property Profile of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride
Property Insights of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride
The XLogP value of -0.4 indicates that Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 51.0 Ų, Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride has 2 hydrogen bond donor(s) and 4 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 Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride?
The CAS number of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride is 100311-36-2.
What is the molecular formula of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride?
The molecular formula of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride is C19H32ClNO3.
What is the molecular weight of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride?
The molecular weight of Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride is 357.21 g/mol.
Where can I buy Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride?
You can request a quote for Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-(2-(diethylamino)ethoxy)-3,5-dipropyl-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.