3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid
TL;DR: 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid (CAS 190897-47-3) is a chemical compound with molecular formula C9H17NO4 and molecular weight 203.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid, Boc-DL-3-Aminoisobutyric acid, boc-dL-beta-aib-OH, N-Methyl CL-Serine, Boc-DL-Aib(3)-OH
| Molecular Formula | C9H17NO4 |
|---|---|
| Molecular Weight | 203.12 g/mol |
| LogP | 1.2318 |
| Topological Polar Surface Area | 75.63 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.11575 |
| Heavy Atoms | 14 |
| Complexity | 219.34207 |
Chemical Identifiers
| CAS Number | 190897-47-3 |
|---|---|
| SMILES | CC(CNC(=O)OC(C)(C)C)C(=O)O |
Product Overview
3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid (CAS 190897-47-3), with molecular formula C9H17NO4 and molecular weight 203.12 g/mol. IUPAC: 2-methyl-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid.
Chemical Property Profile of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid
Property Insights of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid
The XLogP value of 1.2318 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid. The TPSA of 75.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid. Following Lipinski's Rule of Five, 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic 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 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid?
The CAS number of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid is 190897-47-3.
What is the molecular formula of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid?
The molecular formula of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid is C9H17NO4.
What is the molecular weight of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid?
The molecular weight of 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid is 203.12 g/mol.
Where can I buy 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid?
You can request a quote for 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic 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)-2-methylpropanoic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-((tert-Butoxycarbonyl)amino)-2-methylpropanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.