Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid
TL;DR: Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid (CAS 269398-94-9) is a chemical compound with molecular formula C25H18F5NO4 and molecular weight 491.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(2,3,4,5,6-pentafluorophenyl)butanoic acid
Also Known As: Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid, Fmoc-L-beta-HomoPhe(F)5-OH, Fmoc-Phe(F5)-(C#CH2)OH, Fmoc-pentafluoro-L-beta-homophenylalanine, (S)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-(perfluorophenyl)butanoic acid
| Molecular Formula | C25H18F5NO4 |
|---|---|
| Molecular Weight | 491.12 g/mol |
| LogP | 5.3066 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 491.1156 |
| Heavy Atoms | 35 |
| Complexity | 1238.5049 |
Chemical Identifiers
| CAS Number | 269398-94-9 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=C(C(=C(C(=C4F)F)F)F)F)CC(=O)O |
Product Overview
Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid (CAS 269398-94-9), with molecular formula C25H18F5NO4 and molecular weight 491.12 g/mol. IUPAC: (3S)-3-(9H-fluoren-9-ylmethoxycarbonylamino)-4-(2,3,4,5,6-pentafluorophenyl)butanoic acid.
Chemical Property Profile of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid
Property Insights of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid
The XLogP value of 5.3066 indicates that Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric 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 Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid. Following Lipinski's Rule of Five, Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid?
The CAS number of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid is 269398-94-9.
What is the molecular formula of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid?
The molecular formula of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid is C25H18F5NO4.
What is the molecular weight of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid?
The molecular weight of Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid is 491.12 g/mol.
Where can I buy Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid?
You can request a quote for Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid?
Yes, KEHONG BIO provides custom synthesis services for Fmoc-(S)-3-Amino-4-(pentafluoro-phenyl)-butyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.