1-(1,1-Dimethylethyl) hydrogen L-glutamate
TL;DR: 1-(1,1-Dimethylethyl) hydrogen L-glutamate (CAS 45120-30-7) 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.
(4S)-4-amino-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid
Also Known As: h-glu-otbu, 1-tert-Butyl L-glutamate, L-Glu-OtBu, (S)-4-Amino-5-(tert-butoxy)-5-oxopentanoic acid, Glu-OtBu
| Molecular Formula | C9H17NO4 |
|---|---|
| Molecular Weight | 203.12 g/mol |
| LogP | -2.2 |
| Topological Polar Surface Area | 89.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 203.11575 |
| Heavy Atoms | 14 |
| Complexity | 219.0 |
Chemical Identifiers
| CAS Number | 45120-30-7 |
|---|---|
| SMILES | CC(C)(C)OC(=O)[C@H](CCC(=O)O)N |
| InChIKey | QVAQMUAKTNUNLN-LURJTMIESA-N |
Patent-Derived Application Labels
Derived from 8 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(1,1-Dimethylethyl) hydrogen L-glutamate (CAS 45120-30-7), with molecular formula C9H17NO4 and molecular weight 203.12 g/mol. IUPAC: (4S)-4-amino-5-[(2-methylpropan-2-yl)oxy]-5-oxopentanoic acid.
Chemical Property Profile of 1-(1,1-Dimethylethyl) hydrogen L-glutamate
Property Insights of 1-(1,1-Dimethylethyl) hydrogen L-glutamate
The XLogP value of -2.2 indicates that 1-(1,1-Dimethylethyl) hydrogen L-glutamate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 89.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(1,1-Dimethylethyl) hydrogen L-glutamate. Following Lipinski's Rule of Five, 1-(1,1-Dimethylethyl) hydrogen L-glutamate 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 1-(1,1-Dimethylethyl) hydrogen L-glutamate?
The CAS number of 1-(1,1-Dimethylethyl) hydrogen L-glutamate is 45120-30-7.
What is the molecular formula of 1-(1,1-Dimethylethyl) hydrogen L-glutamate?
The molecular formula of 1-(1,1-Dimethylethyl) hydrogen L-glutamate is C9H17NO4.
What is the molecular weight of 1-(1,1-Dimethylethyl) hydrogen L-glutamate?
The molecular weight of 1-(1,1-Dimethylethyl) hydrogen L-glutamate is 203.12 g/mol.
Where can I buy 1-(1,1-Dimethylethyl) hydrogen L-glutamate?
You can request a quote for 1-(1,1-Dimethylethyl) hydrogen L-glutamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1,1-Dimethylethyl) hydrogen L-glutamate?
Yes, KEHONG BIO provides custom synthesis services for 1-(1,1-Dimethylethyl) hydrogen L-glutamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.