| Identification | Back Directory | [Name]
Methyl 4-aminobutyrate hydrochloride | [CAS]
13031-60-2 | [Synonyms]
>=99.0% (AT)
H-GABA-Ome.HCl
L-4-Abu-Ome.Hcl
L-γ-Abu-OMe·HCl
Methyl 4-aminobutyrate HCl
METHYL 4-AMINOBUTANOATE HCL
GABA Methyl Ester Hydrochloride
4-Aminobutyric acid methyl ester HCl
METHYL 4-AMINOBUTYRATE HYDROCHLORIDE
METHYL 4-AMINOBUTANOATE HYDROCHLORIDE
4-Aminobutanoic acid methyl ester HCl
(4-methoxy-4-oxobutyl)azanium chloride
(4-methoxy-4-oxo-butyl)azanium chloride
(4-methoxy-4-oxobutyl)ammonium chloride
4-METHOXY-4-OXOBUTAN-1-AMINIUM CHLORIDE
(4-methoxy-4-oxo-butyl)ammonium chloride
(4-keto-4-methoxy-butyl)ammonium chloride
Methyl 4-aminobutyrate hydrochloride ,99%
butyricacid,4-amino-,methylester,hydrochloride
Methyl 4-aminobutyrate hydrochloride USP/EP/BP
γ-Aminobutylic acid methyl ester hydrochloride
4-aminobutanoic acid methyl ester hydrochloride
4-AMINOBUTYRIC ACID METHYL ESTER, HYDROCHLORIDE
4-AMINO-N-BUTYRIC ACID METHYL ESTER HYDROCHLORIDE
Methyl 4-aMinobutyrate hydrochloride >=99.0% (AT)
Butanoic acid, 4-aMino-, Methyl ester, hydrochloride
4-Aminobutyric acid methyl ester, hydrochloride ,99%
Methyl 4-aminobutyrate hydrochloride≥ 99%(Titration)
Butanoic acid, 4-amino-, methyl ester, hydrochloride (1:1) | [EINECS(EC#)]
629-526-4 | [Molecular Formula]
C5H12ClNO2 | [MDL Number]
MFCD00043270 | [MOL File]
13031-60-2.mol | [Molecular Weight]
153.61 |
| Chemical Properties | Back Directory | [Melting point ]
120-125 °C(lit.)
| [storage temp. ]
Inert atmosphere,Room Temperature | [form ]
powder to crystal | [color ]
White to Almost white | [BRN ]
3558996 | [Major Application]
peptide synthesis | [InChI]
InChI=1S/C5H11NO2.ClH/c1-8-5(7)3-2-4-6;/h2-4,6H2,1H3;1H | [InChIKey]
WPGPRLVPWACBHW-UHFFFAOYSA-N | [SMILES]
C(=O)(OC)CCCN.Cl |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
36/37/38 | [Safety Statements ]
26-36/37 | [WGK Germany ]
3
| [RTECS ]
ES7065000
| [F ]
3 | [HazardClass ]
IRRITANT | [HS Code ]
2922498590 | [Storage Class]
11 - Combustible Solids | [Hazard Classifications]
Eye Irrit. 2
Skin Irrit. 2
STOT SE 3 |
| Hazard Information | Back Directory | [Chemical Properties]
White crystalline powder | [Uses]
Methyl 4-aminobutyrate, HCl | [reaction suitability]
reaction type: solution phase peptide synthesis | [Synthesis]
GENERAL METHOD: Thionyl chloride (20 mmol) was added slowly and dropwise to a 20 mL methanol solution of gamma-aminobutyric acid (10 mmol) under ice bath conditions. The reaction mixture was stirred at room temperature for about 2 h before the solvent was removed by rotary evaporator to give methyl 4-aminobutyrate hydrochloride (11a). The product was a white solid in 96.0% yield.1H NMR (400 MHz, D2O) δ 3.46 (s, 3H), 2.79 (t, J = 7.6 Hz, 2H), 2.28 (t, J = 7.3 Hz, 2H), 1.77-1.67 (m, 2H).ESI-MS analysis showed that the calculated value of [M + H-HCl]+ m/z was 118.1 and the measured value was 118.1. | [References]
[1] Journal of Medicinal Chemistry, 1984, vol. 27, # 10, p. 1263 - 1267
[2] Synthetic Communications, 1998, vol. 28, # 3, p. 471 - 474
[3] Tetrahedron Letters, 2005, vol. 46, # 47, p. 8137 - 8140
[4] Chemistry - A European Journal, 2012, vol. 18, # 18, p. 5767 - 5776
[5] Journal of Medicinal Chemistry, 2006, vol. 49, # 20, p. 6094 - 6103 |
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