(R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid
TL;DR: (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid (CAS 127106-71-2) is a chemical compound with molecular formula C15H20N2O6 and molecular weight 324.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)butanoic acid
Also Known As: (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid, Boc-(R)-3-Amino-4-(4-nitrophenyl)butanoic acid, Boc-(R)-3-Amino-4-(4-nitro-phenyl)-butyric acid, Boc-D-b-HoPhe(4-NO2)-OH, Boc-D-beta-HPhe(4-NO2)-OH
| Molecular Formula | C15H20N2O6 |
|---|---|
| Molecular Weight | 324.13 g/mol |
| LogP | 2.5053 |
| Topological Polar Surface Area | 118.77 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 324.13214 |
| Heavy Atoms | 23 |
| Complexity | 576.62506 |
Chemical Identifiers
| CAS Number | 127106-71-2 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@H](CC1=CC=C(C=C1)[N+](=O)[O-])CC(=O)O |
Product Overview
(R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid (CAS 127106-71-2), with molecular formula C15H20N2O6 and molecular weight 324.13 g/mol. IUPAC: (3R)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(4-nitrophenyl)butanoic acid.
Chemical Property Profile of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid
Property Insights of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid
The XLogP value of 2.5053 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid. The TPSA of 118.77 Ų falls within the moderate polarity range, balancing permeability and solubility for (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid. Following Lipinski's Rule of Five, (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid has 2 hydrogen bond donor(s) and 5 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 (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid?
The CAS number of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid is 127106-71-2.
What is the molecular formula of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid?
The molecular formula of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid is C15H20N2O6.
What is the molecular weight of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid?
The molecular weight of (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid is 324.13 g/mol.
Where can I buy (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid?
You can request a quote for (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid?
Yes, KEHONG BIO provides custom synthesis services for (R)-3-((tert-Butoxycarbonyl)amino)-4-(4-nitrophenyl)butanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.