L-Aspartic acid diethyl ester hydrochloride
L-Aspartic acid diethyl ester hydrochloride structure
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Common Name | L-Aspartic acid diethyl ester hydrochloride | ||
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| CAS Number | 16115-68-7 | Molecular Weight | 225.670 | |
| Density | 1.102g/cm3 | Boiling Point | 259.5ºC at 760mmHg | |
| Molecular Formula | C8H16ClNO4 | Melting Point | 105.0 to 109.0 °C | |
| MSDS | Chinese USA | Flash Point | 97.5ºC | |
Use of L-Aspartic acid diethyl ester hydrochlorideH-Asp(Oet)-OEt.HCl is an aspartic acid derivative[1]. |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | L-Aspartic acid diethyl ester hydrochloride |
|---|---|
| Synonym | More Synonyms |
This table contains bioactivity, target information and biological‑assay experimental data of this compound.
| Description | H-Asp(Oet)-OEt.HCl is an aspartic acid derivative[1]. |
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| Related Catalog | |
| In Vitro | Amino acids and amino acid derivatives have been commercially used as ergogenic supplements. They influence the secretion of anabolic hormones, supply of fuel during exercise, mental performance during stress related tasks and prevent exercise induced muscle damage. They are recognized to be beneficial as ergogenic dietary substances[1]. |
| References |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.102g/cm3 |
|---|---|
| Boiling Point | 259.5ºC at 760mmHg |
| Melting Point | 105.0 to 109.0 °C |
| Molecular Formula | C8H16ClNO4 |
| Molecular Weight | 225.670 |
| Flash Point | 97.5ºC |
| Exact Mass | 225.076782 |
| PSA | 78.62000 |
| LogP | 1.33230 |
| Appearance of Characters | Solid |
| Vapour Pressure | 0.0129mmHg at 25°C |
| Index of Refraction | 1.45 |
| InChIKey | AJOXZAAREAYBQR-RGMNGODLSA-N |
| SMILES | CCOC(=O)CC(N)C(=O)OCC.Cl |
| Storage condition | Store at 0°C |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
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Material Safety Data Sheet
Section1. Identification of the substance Product Name: H-Asp(OEt)-OEt HCl Synonyms: Section2. Hazards identification Harmful by inhalation, in contact with skin, and if swallowed. Section3. Composition/information on ingredients. Ingredient name:H-Asp(OEt)-OEt HCl CAS number:16115-68-7 Section4. First aid measures Skin contact:Immediately wash skin with copious amounts of water for at least 15 minutes while removing contaminated clothing and shoes. If irritation persists, seek medical attention. Eye contact:Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical attention. Inhalation:Remove to fresh air. In severe cases or if symptoms persist, seek medical attention. Ingestion:Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention. Section5. Fire fighting measures In the event of a fire involving this material, alone or in combination with other materials, use dry powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus should be worn. Section6. Accidental release measures Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national standards. Respiratory precaution:Wear approved mask/respirator Hand precaution:Wear suitable gloves/gauntlets Skin protection:Wear suitable protective clothing Eye protection:Wear suitable eye protection Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container for disposal. See section 12. Environmental precautions: Do not allow material to enter drains or water courses. Section7. Handling and storage Handling:This product should be handled only by, or under the close supervision of, those properly qualified in the handling and use of potentially hazardous chemicals, who should take into account the fire, health and chemical hazard data given on this sheet. Store in closed vessels. Storage: Section8. Exposure Controls / Personal protection Engineering Controls: Use only in a chemical fume hood. Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles. General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse. Section9. Physical and chemical properties Appearance:Not specified Boiling point:No data No data Melting point: Flash point:No data Density:No data Molecular formula:C8H15NO4.ClH Molecular weight:225.7 Section10. Stability and reactivity Conditions to avoid: Heat, flames and sparks. Materials to avoid: Oxidizing agents. Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen chloride. Section11. Toxicological information No data. Section12. Ecological information No data. Section13. Disposal consideration Arrange disposal as special waste, by licensed disposal company, in consultation with local waste disposal authority, in accordance with national and regional regulations. Section14. Transportation information Non-harzardous for air and ground transportation. Section15. Regulatory information No chemicals in this material are subject to the reporting requirements of SARA Title III, Section 302, or have known CAS numbers that exceed the threshold reporting levels established by SARA Title III, Section 313. SECTION 16 - ADDITIONAL INFORMATION N/A |
This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Hazard Codes | Xi |
|---|---|
| RIDADR | NONH for all modes of transport |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
L-Aspartic acid... CAS#:16115-68-7 |
| Literature: LUDWIG-MAXIMILIANS-UNIVERSITAET MUENCHEN Patent: WO2006/94770 A2, 2006 ; Location in patent: Page/Page column 12-13 ; |
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~%
L-Aspartic acid... CAS#:16115-68-7 |
| Literature: US4215070 A1, ; |
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~%
L-Aspartic acid... CAS#:16115-68-7 |
| Literature: Synthesis, , # 20 art. no. N44611SS, p. 3247 - 3254 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 3 | |
|---|---|
| DownStream 0 | |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| Diethyl L-aspartate hydrochloride (1:1) |
| H-ASP(OET)-OET HCL |
| H-Asp(OEt)-OEt hydrochloride |
| Diethyl L-Aspartate Hydrochloride |
| L-Aspartic Acid Diethyl Ester Hydrochloride |
| H-Asp(OEt)-OEt·HCl |
| L-Aspartic acid, diethyl ester, hydrochloride (1:1) |
| H-Asp(OEt)-OEt.HCl |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the molecular weight of L-Aspartic acid diethyl ester hydrochloride? |
| A: Molecular weight of L-Aspartic acid diethyl ester hydrochloride is 225.670. |
| Q: What is the boiling point of L-Aspartic acid diethyl ester hydrochloride? |
| A: Boiling point of L-Aspartic acid diethyl ester hydrochloride is 259.5ºC at 760mmHg. |
| Q: What is the SMILES notation of L-Aspartic acid diethyl ester hydrochloride? |
| A: SMILES notation of L-Aspartic acid diethyl ester hydrochloride is CCOC(=O)CC(N)C(=O)OCC.Cl. |
| Q: What is the molecular formula of L-Aspartic acid diethyl ester hydrochloride? |
| A: Molecular formula of L-Aspartic acid diethyl ester hydrochloride is C8H16ClNO4. |
| Q: What is the English name of L-Aspartic acid diethyl ester hydrochloride? |
| A: The English name of L-Aspartic acid diethyl ester hydrochloride is L-Aspartic acid diethyl ester hydrochloride. |
| Q: What is the melting point of L-Aspartic acid diethyl ester hydrochloride? |
| A: Melting point of L-Aspartic acid diethyl ester hydrochloride is 105.0 to 109.0 °C. |
| Q: What is the LogP of L-Aspartic acid diethyl ester hydrochloride? |
| A: LogP of L-Aspartic acid diethyl ester hydrochloride is 1.33230. |
| Q: What is the CAS number of L-Aspartic acid diethyl ester hydrochloride? |
| A: CAS number of L-Aspartic acid diethyl ester hydrochloride is 16115-68-7. |
| Q: What are the uses of L-Aspartic acid diethyl ester hydrochloride? |
| A: Main uses of L-Aspartic acid diethyl ester hydrochloride: H-Asp(Oet)-OEt.HCl is an aspartic acid derivative[1]. |
| Q: What are the storage conditions for L-Aspartic acid diethyl ester hydrochloride? |
| A: Storage conditions for L-Aspartic acid diethyl ester hydrochloride: Store at 0°C. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |