CAS 32677-01-3|H-Glu(OtBu)-OtBu.HCl
| Common Name | H-Glu(OtBu)-OtBu.HCl | ||
|---|---|---|---|
| CAS Number | 32677-01-3 | Molecular Weight | 295.803 |
| Density | 1.02g/cm3 | Boiling Point | 311.1ºC at 760 mmHg |
| Molecular Formula | C13H26ClNO4 | Melting Point | 60 to 75ºC |
| MSDS | USA | Flash Point | 78.1ºC |
Names
| Name | ditert-butyl (2S)-2-aminopentanedioate,hydrochloride |
|---|---|
| Synonym | More Synonyms |
H-Glu(OtBu)-OtBu.HCl BiologicalActivity
| Description | H-Glu(OtBu)-OtBu hydrochloride is a glutamate derivative that can be used for substance P antagonist synthesis[1]. |
|---|---|
| Related Catalog | Signaling Pathways >>Neuronal Signaling >>Neurokinin ReceptorResearch Areas >>Neurological DiseaseSignaling Pathways >>GPCR/G Protein >>Neurokinin Receptor |
| Target | Substance P[1] |
| References | [1]. Manolopoulou A, et al. Synthesis of potent antagonists of substance P by modifying the methionyl and glutaminyl residues of its C-terminal hexapeptide and without using D-amino acids. Int J Pept Protein Res. 1993 Apr;41(4):411-4. |
Chemical & Physical Properties
| Density | 1.02g/cm3 |
|---|---|
| Boiling Point | 311.1ºC at 760 mmHg |
| Melting Point | 60 to 75ºC |
| Molecular Formula | C13H26ClNO4 |
| Molecular Weight | 295.803 |
| Flash Point | 78.1ºC |
| Exact Mass | 295.155029 |
| PSA | 78.62000 |
| LogP | 3.27960 |
| InChIKey | LFEYMWCCUAOUKZ-FVGYRXGTSA-N |
| SMILES | CC(C)(C)OC(=O)CCC(N)C(=O)OC(C)(C)C.Cl |
| Storage condition | −20°C |
Toxicological Information
CHEMICAL IDENTIFICATION |
ACUTE TOXICITY DATA - TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - rat
- DOSE/DURATION :
- 148 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- NTOTDY Neurobehavioral Toxicology and Teratology. (Fayetteville, NY) V.3-8, 1981-86. For publisher information, see NETEEC. Volume(issue)/page/year: 7,275,1985
- TYPE OF TEST :
- LDLo - Lowest published lethal dose
- ROUTE OF EXPOSURE :
- Intraperitoneal
- SPECIES OBSERVED :
- Rodent - mouse
- DOSE/DURATION :
- 148 mg/kg
- TOXIC EFFECTS :
- Behavioral - convulsions or effect on seizure threshold
- REFERENCE :
- NTOTDY Neurobehavioral Toxicology and Teratology. (Fayetteville, NY) V.3-8, 1981-86. For publisher information, see NETEEC. Volume(issue)/page/year: 7,275,1985
Safety Information
| Personal Protective Equipment | Eyeshields;Gloves;type N95 (US);type P1 (EN143) respirator filter |
|---|---|
| Hazard Codes | Xi |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 3 |
| RTECS | MA0880000 |
Articles3
More Articles| Synthesis and biological activity of analogues of the C-terminal hexapeptide of substance P with modifications at glutaminyl and methioninyl residues. Structure-activity studies. Int. J. Pept. Protein Res. 40 , 395-400, (1992) Analogues of [Orn6]-SP6-11 have been synthesized in which the methionyl residue is replaced by glutamine gamma-carboxamide substituted derivatives. These analogues where tested in three in vitro prepa... | |
| Synthesis of potent antagonists of substance P by modifying the methionyl and glutaminyl residues of its C-terminal hexapeptide and without using D-amino acids. Int. J. Pept. Protein Res. 41 , 411-414, (1993) Analogues of [Orn6]-SP6-11 have been synthesized in which the Met11-NH2 residue is replaced by the alpha, gamma-dimethyl, alpha, gamma-dibenzyl and alpha, gamma-di-tert-butyl esters of glutamic acid. ... | |
| Convulsant properties of L-glutamic acid di-tert butyl ester. Neurobehav. Toxicol. Teratol. 7 , 275-278, (1985) Glutamic acid di-tert butyl ester (GTBE) was found to have a pronounced convulsant effect in mice and rats, producing recurrent clonic convulsions combined with postural and respiratory disturbances i... |
Synonyms
| H-Glu(OtBu)-OtBu·HCl |
| H-Glu(OtBu)-OtBu��HCl |
| L-glutamic acid di-t-butyl ester hydrochloride |
| MFCD00058003 |
| Di-tert-butyl L-glutamate hydrochloride (1:1) |
| L-Glutamic acid, bis(1,1-dimethylethyl) ester, hydrochloride (1:1) |
| H-Glu(OtBu)-OtBu,HCl |
| H-L-Glu(OtBu)-OtBu*HCl |
| L-Glutamic acid di-tert |
| L-Glutamic Acid di-Tert-Butyl Ester Hydrochloride |
| Bis(2-methyl-2-propanyl) L-glutamate hydrochloride (1:1) |
| (S)-Di-tert-butyl 2-aminopentanedioate hydrochloride |
| H-Glu(OtBu)-OtBu.HCl |
| L-Glutamic acid di-tert-butylester hydrochloride |
