ChemicalBook--->CAS DataBase List--->13031-60-2

13031-60-2

13031-60-2 Structure

13031-60-2 Structure
IdentificationBack 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 PropertiesBack 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 DataBack 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
Raw materials And Preparation ProductsBack Directory
[Raw materials]

4-[[(1,1-dimethylethoxy)carbonyl]amino]Butanoic acid methyl ester
Hazard InformationBack Directory
[Chemical Properties]

White crystalline powder
[Uses]

Methyl 4-aminobutyrate, HCl
[reaction suitability]

reaction type: solution phase peptide synthesis
[Synthesis]

Methanol

67-56-1

4-Aminobutyric acid

56-12-2

Methyl 4-aminobutyrate hydrochloride

13031-60-2

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
Spectrum DetailBack Directory
[Spectrum Detail]

Methyl 4-aminobutyrate hydrochloride(13031-60-2)1HNMR
13031-60-2 suppliers list
Company Name: SHANGHAI BANGCHENG CHEMICAL Co.,Ltd.  Gold
Telephone: 021-69106960 13701823997
Website: www.bangchengchem.com/
Company Name: Shanghai Boyle Chemical Co., Ltd.  
Telephone:
Website: www.boylechem.com
Company Name: J & K SCIENTIFIC LTD.  
Telephone: 18210857532 18210857532
Website: https://www.jkchemical.com
Company Name: Energy Chemical  
Telephone: 400-0056266
Website: www.energy-chemical.com
Company Name: Wuhan Chemwish Technology Co., Ltd  
Telephone: 86-027-67849912
Website: www.chemwish.com
Company Name: Shanghai Sinch Parmaceuticals Tech. Co. Ltd.  
Telephone: +86-21-54098501
Website: www.sinch.com.cn
Company Name: Jia Xing Isenchem Co.,Ltd  
Telephone: 0573-85285100 18627885956
Website: https://www.chemicalbook.com/ShowSupplierProductsList14265/0_EN.htm
Company Name: Accela ChemBio Co.,Ltd.  
Telephone: 021-50795510 4000665055
Website: http://www.shao-yuan.com/
Company Name: Shanghai Hanhong Scientific Co.,Ltd.  
Telephone: 021-54306202 13764082696
Website: https://www.hanhongsci.com
Company Name: Syntechem Co.,Ltd  
Telephone:
Website: www.syntechem.com
Company Name: Tianjin heowns Biochemical Technology Co., Ltd.  
Telephone: 400 638 7771
Website: www.heowns.com
Company Name: Hangzhou Sage Chemical Co., Ltd.  
Telephone: +86057186818502 13588463833
Website: www.sagechem.com
Company Name: Thermo Fisher Scientific  
Telephone: 800-810-5118
Website: www.thermo.com.cn
Company Name: Shanghai Topbiochem Technology Co., Ltd  
Telephone: 021-58170097
Website: www.topbiochem.com
Company Name: Shanghai Aladdin Bio-Chem Technology Co.,LTD  
Telephone: 400-6206333 13167063860
Website: www.aladdin-e.com/
Company Name: Shanghai Raise Chemical Technology Co.,Ltd  
Telephone: +86-021-50935922
Website: www.raise-chem.com
Company Name: TargetMol Chemicals Inc.  
Telephone: 021-021-33632979 15002134094
Website: https://www.targetmol.cn/
Company Name: YangZhou Ruihong Biotech Co., Ltd.  
Telephone: 0514-015380367604 15380367604
Website: https://www.ruihongbiotech.com
Tags:13031-60-2 Related Product Information
26727-22-0 58640-01-0 74223-64-6 119413-54-6 96-33-3 119-36-8 143390-89-0 79-20-9 15118-60-2 56-12-2 101200-48-0 74-83-9 1118-89-4 23150-65-4 623-42-7 32677-01-3 52763-21-0 6937-16-2