N-Methyl-4-aminobutyric acid - ≥97% , CAS No.1119-48-8

CAS: 1119-48-8 Cat. No.: M276212 Peso molecular: 117.15 Número EC: 808-376-5

GRADE & PURITY ≥97%

Synonyms

3LC3P8KU3H | AMY5046 | J-002673 | gamma-methylaminobutyric acid | Viticolor | dihydroxyacetone 3-phosphate | N,N-Dimethylaminoacetic acid | MFCD00044627 | UNII-3LC3P8KU3H | AS-44843 | 4-Methylaminobutyrate | 1,4-Dihydroxy-2-naphtoic acid | methyl-3-carbox

Storage

Protected from light,Store at -20°C,Desiccated

Shipped In

Ice chest + Ice pads

Descripción general

Store at -20°C. Store In the Dark. Store under desiccating conditions. This product is air and light sensitive and impurities can occur as a result of air oxidation or due to metabolism by microbes.

Specifications

Sinónimos

3LC3P8KU3H | AMY5046 | J-002673 | gamma-methylaminobutyric acid | Viticolor | dihydroxyacetone 3-phosphate | N, N-Dimethylaminoacetic acid | MFCD00044627 | UNII-3LC3P8KU3H | AS-44843 | 4-Methylaminobutyrate | 1, 4-Dihydroxy-2-naphtoic acid | methyl-3-carbox

Especificaciones y pureza

≥97%

Mecanismos bioquímicos y fisiológicos

GABA derivative and hydrolysis product of N-methyl-2-pyrrolidinone. Product of nicotine catabolism in bacteria. Inhibits L-Carnitine uptake in cultured rat cortical neurons.

Condiciones de almacenamiento de almacenamiento

Protected from light, Store at -20°C, Desiccated

Enviado en

Ice chest + Ice pads

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Nota

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Pureza

≥97%

Nombres e identificadores

• Sonrisas canónicas: CNCCCC(=O)O
• IUPAC Name: 4-(methylamino)butanoic acid
• InChIKey: AOKCDAVWJLOAHG-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO2/c1-6-4-2-3-5(7)8/h6H,2-4H2,1H3,(H,7,8)
• Isómeros SMILES: CNCCCC(=O)O
• Peso molecular: 117.15
• Reaxy-Rn: 1744840
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1744840&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Clase Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Level5 Amino acids and derivatives
          • Level6 Gamma amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Clase: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Gamma amino acids and derivatives
• Alternative Parents: Amino fatty acids Straight chain fatty acids Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Gamma amino acid or derivatives - Amino fatty acid - Straight chain fatty acid - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Amine - Carbonyl group - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as gamma amino acids and derivatives. These are amino acids having a (-NH2) group attached to the gamma carbon atom.
• External Descriptors: gamma-amino acid

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mecanismos de acción

Propiedades químicas y físicas

• Solubilidad: DMSO (with heating), Water
• Sensibilidad: air and light sensitive
• Peso molecular: 117.150 g/mol
• XLogP3: -2.600
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 117.079 Da
• Monoisotopic Mass: 117.079 Da
• Topological Polar Surface Area: 49.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 72.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Referencias

1. Hailong Wei, Fangwei Gu, Yongsheng Wang, Jinyuan Hao, Wei Zhu, Zhongbin Zhuang.  (2023)  Synthesis of Pure-Phase Ni2P Nanocatalysts via Phosphorus Ligand Selection for Efficient Hydrogen Evolution Reaction.  ChemElectroChem,      [PMID:] [10.1002/celc.202300426]