二叔丁基谷氨酸酯
TL;DR: 二叔丁基谷氨酸酯 (CAS 16874-06-9) is a chemical compound with molecular formula C13H25NO4 and molecular weight 259.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
二叔丁基谷氨酸酯
ditert-butyl 2-aminopentanedioate
Also Known As: Di-tert-butyl glutamate, GTBE, Bis(tert-butyl) L-glutamate, ditert-butyl 2-aminopentanedioate, glutamic acid di-tert-butyl ester
| Molecular Formula | C13H25NO4 |
|---|---|
| Molecular Weight | 259.18 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 78.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 259.17834 |
| Heavy Atoms | 18 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 16874-06-9 |
|---|---|
| SMILES | CC(C)(C)OC(=O)CCC(C(=O)OC(C)(C)C)N |
| InChIKey | NTUGPDFKMVHCCJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
二叔丁基谷氨酸酯 (CAS 16874-06-9), with molecular formula C13H25NO4 and molecular weight 259.18 g/mol. IUPAC: ditert-butyl 2-aminopentanedioate.
Chemical Property Profile of 二叔丁基谷氨酸酯
Property Insights of 二叔丁基谷氨酸酯
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 二叔丁基谷氨酸酯. The TPSA of 78.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 二叔丁基谷氨酸酯. Following Lipinski's Rule of Five, 二叔丁基谷氨酸酯 has 1 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 二叔丁基谷氨酸酯?
The CAS number of 二叔丁基谷氨酸酯 is 16874-06-9.
What is the molecular formula of 二叔丁基谷氨酸酯?
The molecular formula of 二叔丁基谷氨酸酯 is C13H25NO4.
What is the molecular weight of 二叔丁基谷氨酸酯?
The molecular weight of 二叔丁基谷氨酸酯 is 259.18 g/mol.
Where can I buy 二叔丁基谷氨酸酯?
You can request a quote for 二叔丁基谷氨酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 二叔丁基谷氨酸酯?
Yes, KEHONG BIO provides custom synthesis services for 二叔丁基谷氨酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.