![3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid structure](/static/products/963/96382-48-8.png)
3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid
TL;DR: 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid (CAS 96382-48-8) is a chemical compound with molecular formula C15H21NO5 and molecular weight 295.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(4-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: 3-[(tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid, 3-((tert-Butoxycarbonyl)amino)-3-(4-methoxyphenyl)propanoic acid, 3-(Boc-amino)-3-(4-methoxyphenyl)propionic acid, (s)-boc-4-methoxy-bera-phe-oh, Boc-beta-3-(4-methoxyphenyl)alanine
| Molecular Formula | C15H21NO5 |
|---|---|
| Molecular Weight | 295.14 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 295.14197 |
| Heavy Atoms | 21 |
| Complexity | 356.0 |
Chemical Identifiers
| CAS Number | 96382-48-8 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=C(C=C1)OC |
| InChIKey | OPAAZWPTEYZZIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid (CAS 96382-48-8), with molecular formula C15H21NO5 and molecular weight 295.14 g/mol. IUPAC: 3-(4-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid
Property Insights of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid. Following Lipinski's Rule of Five, 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic 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 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid?
The CAS number of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid is 96382-48-8.
What is the molecular formula of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid?
The molecular formula of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid is C15H21NO5.
What is the molecular weight of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid?
The molecular weight of 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid is 295.14 g/mol.
Where can I buy 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid?
You can request a quote for 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic 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-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[(Tert-butoxycarbonyl)amino]-3-(4-methoxyphenyl)propanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.