3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid
TL;DR: 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid (CAS 182344-65-6) is a chemical compound with molecular formula C16H23NO4 and molecular weight 293.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-ethylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid, AA152, 3-((tert-Butoxycarbonyl)amino)-3-(4-ethylphenyl)propanoic acid, 3-(Boc-amino)-3-(4-ethylphenyl)propanoic acid, 3-[(tert-butoxycarbonyl)amino]-3-(4-ethylphenyl)propanoic acid
| Molecular Formula | C16H23NO4 |
|---|---|
| Molecular Weight | 293.16 g/mol |
| LogP | 3.2895 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 293.16272 |
| Heavy Atoms | 21 |
| Complexity | 487.9936 |
Chemical Identifiers
| CAS Number | 182344-65-6 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)C(CC(=O)O)NC(=O)OC(C)(C)C |
Product Overview
3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid (CAS 182344-65-6), with molecular formula C16H23NO4 and molecular weight 293.16 g/mol. IUPAC: 3-(4-ethylphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid
Property Insights of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid
The XLogP value of 3.2895 indicates that 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid. Following Lipinski's Rule of Five, 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid has 2 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-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid?
The CAS number of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid is 182344-65-6.
What is the molecular formula of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid?
The molecular formula of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid is C16H23NO4.
What is the molecular weight of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid?
The molecular weight of 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid is 293.16 g/mol.
Where can I buy 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid?
You can request a quote for 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-tert-Butoxycarbonylamino-3-(4-ethyl-phenyl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.