tert-Butyl ((tert-butoxycarbonyl)amino)acetate
TL;DR: tert-Butyl ((tert-butoxycarbonyl)amino)acetate (CAS 111652-20-1) is a chemical compound with molecular formula C11H21NO4 and molecular weight 231.14706 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate
Also Known As: Boc-Gly-OtBu, Boc-glycine tert-butyl ester, t-BuO2CCH2NHBoc, tert-Butyl 2-((tert-butoxycarbonyl)amino)acetate, N-Boc-glycine tert-Butyl Ester
Technical Specifications
| Molecular Formula | C11H21NO4 |
| Molecular Weight | 231.14706 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 64.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 231.14706 Da |
| Heavy Atoms | 16 |
| Complexity | 260.0 |
| SMILES | CC(C)(C)OC(=O)CNC(=O)OC(C)(C)C |
| InChIKey | ZDKFMHKWZATBMR-UHFFFAOYSA-N |
Chemical Property Profile of tert-Butyl ((tert-butoxycarbonyl)amino)acetate
Property Insights of tert-Butyl ((tert-butoxycarbonyl)amino)acetate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for tert-Butyl ((tert-butoxycarbonyl)amino)acetate. The TPSA of 64.6 Ų falls within the moderate polarity range, balancing permeability and solubility for tert-Butyl ((tert-butoxycarbonyl)amino)acetate. Following Lipinski's Rule of Five, tert-Butyl ((tert-butoxycarbonyl)amino)acetate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of tert-Butyl ((tert-butoxycarbonyl)amino)acetate?
The CAS number of tert-Butyl ((tert-butoxycarbonyl)amino)acetate is 111652-20-1.
What is the molecular formula of tert-Butyl ((tert-butoxycarbonyl)amino)acetate?
The molecular formula of tert-Butyl ((tert-butoxycarbonyl)amino)acetate is C11H21NO4.
What is the molecular weight of tert-Butyl ((tert-butoxycarbonyl)amino)acetate?
The molecular weight of tert-Butyl ((tert-butoxycarbonyl)amino)acetate is 231.14706 g/mol.
Where can I buy tert-Butyl ((tert-butoxycarbonyl)amino)acetate?
You can request a quote for tert-Butyl ((tert-butoxycarbonyl)amino)acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for tert-Butyl ((tert-butoxycarbonyl)amino)acetate?
Yes, CoreyChem provides custom synthesis services for tert-Butyl ((tert-butoxycarbonyl)amino)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.