Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester
TL;DR: Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester (CAS 61706-46-5) is a chemical compound with molecular formula C18H21NO2 and molecular weight 283.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(4-aminophenyl)-2-phenylbutanoate
Also Known As: ethyl 2-(4-aminophenyl)-2-phenylbutanoate, Ethyl 4-amino-alpha-ethyl-alpha-phenylbenzeneacetate, Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester, 4-Amino-alpha-ethyl-alpha-phenylbenzeneacetic acid ethyl ester, RefChem:1078292
| Molecular Formula | C18H21NO2 |
|---|---|
| Molecular Weight | 283.16 g/mol |
| LogP | 3.528 |
| Topological Polar Surface Area | 52.32 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 283.15723 |
| Heavy Atoms | 21 |
| Complexity | 592.3752 |
Chemical Identifiers
| CAS Number | 61706-46-5 |
|---|---|
| SMILES | CCC(C1=CC=CC=C1)(C2=CC=C(C=C2)N)C(=O)OCC |
Product Overview
Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester (CAS 61706-46-5), with molecular formula C18H21NO2 and molecular weight 283.16 g/mol. IUPAC: ethyl 2-(4-aminophenyl)-2-phenylbutanoate.
Chemical Property Profile of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester
Property Insights of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester
The XLogP value of 3.528 indicates that Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.32 Ų, Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester has 1 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 Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester?
The CAS number of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester is 61706-46-5.
What is the molecular formula of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester?
The molecular formula of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester is C18H21NO2.
What is the molecular weight of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester?
The molecular weight of Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester is 283.16 g/mol.
Where can I buy Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester?
You can request a quote for Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Benzeneacetic acid, 4-amino-alpha-ethyl-alpha-phenyl-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.