2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid
TL;DR: 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid (CAS 47376-91-0) is a chemical compound with molecular formula C18H27NO5 and molecular weight 337.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid
Also Known As: Boc-Tyr(tBu)-OH, Boc-D-Tyr(tBu)-OH, Boc-O-tert-butyl-L-tyrosine, BOC-TYR(TBUL)-OH, 2-Hydroxynaphthalene-1-carbonylchloride
| Molecular Formula | C18H27NO5 |
|---|---|
| Molecular Weight | 337.19 g/mol |
| LogP | 3.3843 |
| Topological Polar Surface Area | 84.86 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 337.18893 |
| Heavy Atoms | 24 |
| Complexity | 566.5573 |
Chemical Identifiers
| CAS Number | 47376-91-0 |
|---|---|
| SMILES | CC(C)(C)OC1=CC=C(C=C1)CC(C(=O)O)NC(=O)OC(C)(C)C |
Product Overview
2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid (CAS 47376-91-0), with molecular formula C18H27NO5 and molecular weight 337.19 g/mol. IUPAC: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-[(2-methylpropan-2-yl)oxy]phenyl]propanoic acid.
Chemical Property Profile of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid
Property Insights of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid
The XLogP value of 3.3843 indicates that 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.86 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid. Following Lipinski's Rule of Five, 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid has 2 hydrogen bond donor(s) and 4 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 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid?
The CAS number of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid is 47376-91-0.
What is the molecular formula of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid?
The molecular formula of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid is C18H27NO5.
What is the molecular weight of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid?
The molecular weight of 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid is 337.19 g/mol.
Where can I buy 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid?
You can request a quote for 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-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 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-tert-Butoxycarbonylamino-3-(4-tert-butoxy-phenyl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.