Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride
TL;DR: Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride (CAS 95747-46-9) is a chemical compound with molecular formula C24H34ClNO3 and molecular weight 419.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dibutylamino)ethyl 2-hydroxy-2,2-diphenylacetate;hydrochloride
Also Known As: 2-(Dibutylamino)ethyl benzilate hydrochloride, Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride, 2-(dibutylamino)ethyl 2-hydroxy-2,2-diphenylacetate hydrochloride, 2-(Dibutylamino)ethyl hydroxydi(phenyl)acetate--hydrogen chloride (1/1), RefChem:325749
| Molecular Formula | C24H34ClNO3 |
|---|---|
| Molecular Weight | 419.22 g/mol |
| LogP | 4.7897 |
| Topological Polar Surface Area | 49.77 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 12 |
| Exact Mass | 419.22272 |
| Heavy Atoms | 29 |
| Complexity | 646.2867 |
Chemical Identifiers
| CAS Number | 95747-46-9 |
|---|---|
| SMILES | CCCCN(CCCC)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.Cl |
Product Overview
Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride (CAS 95747-46-9), with molecular formula C24H34ClNO3 and molecular weight 419.22 g/mol. IUPAC: 2-(dibutylamino)ethyl 2-hydroxy-2,2-diphenylacetate;hydrochloride.
Chemical Property Profile of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride
Property Insights of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride
The XLogP value of 4.7897 indicates that Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.77 Ų, Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride has 1 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 Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride?
The CAS number of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride is 95747-46-9.
What is the molecular formula of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride?
The molecular formula of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride is C24H34ClNO3.
What is the molecular weight of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride?
The molecular weight of Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride is 419.22 g/mol.
Where can I buy Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride?
You can request a quote for Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Benzilic acid, 2-(dibutylamino)ethyl ester, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.