| Identification | More | [Name]
Ethyl L-alaninate hydrochloride | [CAS]
1115-59-9 | [Synonyms]
ALANINE ETHYL ESTER HCL
ALANINE-OET HCL
Ethyl L-alaninate hydrochloride
H-ALA-OET HCL
H-ALA-OET HYDROCHLORIDE
L-A-ALANINE, ETHYL ESTER HYDROCHLORIDE
L-ALANINE ETHYL ESTER HCL
L-ALANINE ETHYL ESTER HYDROCHLORIDE
L-ETHYL 2-AMINOPROPANOATE HYDROCHLORIDE
L-ETHYL ALANATE HYDROCHLORIDE
ethyl alaninate hydrochloride
L-ALANINE ETHYL ESTER HCI
H-L-Ala-OEt*HCl
L-Alanine ethyl ester hydrochloride, 98+%
Ethyl (2S)-2-aminopropanoate hydrochloride
Alanine ethyl·hydrochloride | [EINECS(EC#)]
214-225-9 | [Molecular Formula]
C5H12ClNO2 | [MDL Number]
MFCD00063662 | [Molecular Weight]
153.61 | [MOL File]
1115-59-9.mol |
| Chemical Properties | Back Directory | [Appearance]
white to off-white adhering crystalline powder | [Melting point ]
78-80 °C (dec.)(lit.) | [alpha ]
3.1 º (c=2.5, H2O) | [storage temp. ]
0-6°C | [solubility ]
100g/l | [form ]
Solid | [color ]
White to Off-White | [Optical Rotation]
[α]22/D +2.5°, c = 2.5 in H2O | [Sensitive ]
Hygroscopic | [BRN ]
3594395 | [InChI]
InChI=1/C5H11NO2.ClH/c1-3-8-5(7)4(2)6;/h4H,3,6H2,1-2H3;1H/t4-;/s3 | [InChIKey]
JCXLZWMDXJFOOI-NDILARRWNA-N | [SMILES]
C(=O)([C@@H](N)C)OCC.Cl |&1:2,r| | [CAS DataBase Reference]
1115-59-9(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Safety Statements ]
S24/25:Avoid contact with skin and eyes . | [WGK Germany ]
3
| [F ]
3-10 | [Hazard Note ]
Irritant | [HS Code ]
29224995 |
| Hazard Information | Back Directory | [Chemical Properties]
white to off-white adhering crystalline powder | [Uses]
L-Alanine Ethyl Ester Hydrochloride is used in the synthesis of nucleoside phosphoramidates as antiviral agents for human immunodeficiency and hepatitis B viruses. Also used in synthesis of enantiomerically pure amino acid ester isocyanates. | [reaction suitability]
reaction type: solution phase peptide synthesis | [Synthesis]
L-alanine (3.56 g, 0.04 mol) was dissolved in ethanol (30 mL) at -5 °C and thionyl chloride (3.6 mL) was added slowly and dropwise, keeping stirring. Subsequently, the reaction mixture was warmed up to 78 °C and the reaction was refluxed in ethanol for 1.5 hours. Upon completion of the reaction, the solvent was removed by vacuum distillation to afford L-alanine ethyl ester hydrochloride (2a) in over 80% yield. The physical constants of the product 2a were in agreement with the data reported in literature [24]. | [References]
[1] Chemical Communications, 2011, vol. 47, # 26, p. 7347 - 7349
[2] Dalton Transactions, 2015, vol. 44, # 3, p. 1170 - 1177
[3] Tetrahedron, 1999, vol. 55, # 11, p. 3337 - 3354
[4] Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 2006, vol. 45, # 8, p. 1942 - 1944
[5] Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1994, # 7, p. 1455 - 1462 |
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