(2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid
TL;DR: (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid (CAS 142186-36-5) is a chemical compound with molecular formula C13H16FNO4 and molecular weight 269.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid
Also Known As: (S)-2-((tert-Butoxycarbonyl)amino)-2-(4-fluorophenyl)acetic acid, Boc-4-F-Phg-OH, (S)-N-BOC-4-FLUOROPHENYLGLYCINE, -N-BOC-4-FLUOROPHENYLGLYCINE, 6939AA
| Molecular Formula | C13H16FNO4 |
|---|---|
| Molecular Weight | 269.11 g/mol |
| LogP | 2.4761 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 269.10632 |
| Heavy Atoms | 19 |
| Complexity | 464.5267 |
Chemical Identifiers
| CAS Number | 142186-36-5 |
|---|---|
| SMILES | CC(C)(C)OC(=O)N[C@@H](C1=CC=C(C=C1)F)C(=O)O |
Product Overview
(2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid (CAS 142186-36-5), with molecular formula C13H16FNO4 and molecular weight 269.11 g/mol. IUPAC: (2S)-2-(4-fluorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetic acid.
Chemical Property Profile of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid
Property Insights of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid
The XLogP value of 2.4761 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid. Following Lipinski's Rule of Five, (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic 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 (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid?
The CAS number of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid is 142186-36-5.
What is the molecular formula of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid?
The molecular formula of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid is C13H16FNO4.
What is the molecular weight of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid?
The molecular weight of (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid is 269.11 g/mol.
Where can I buy (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid?
You can request a quote for (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (2S)-2-(((tert-butoxy)carbonyl)amino)-2-(4-fluorophenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.