alpha-Methyl-DL-valine - ≥98% , CAS No.26287-62-7

CAS: 26287-62-7 Cat. No.: A354426 Fórmula: C₆H₁₃NO₂ Peso molecular: 131.17

GRADE & PURITY ≥98%

Synonyms

SY115820 | Valine, 2-methyl- | LS-13198 | MFCD00672376 | H--Me-DL-Val-OH | 2-Amino-2,3-dimethylbutanoic acid | 2-AMINO-2,3-DIMETHYL-BUTANOIC ACID | H-Alpha-Me-Dl-Val-Oh | alpha-Methyl-DL-valine | EN300-206248 | SCHEMBL62852 | Isovaline, 3-methyl- | FT-067

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

SY115820 | Valine, 2-methyl- | LS-13198 | MFCD00672376 | H--Me-DL-Val-OH | 2-Amino-2,3-dimethylbutanoic acid | 2-AMINO-2,3-DIMETHYL-BUTANOIC ACID | H-Alpha-Me-Dl-Val-Oh | alpha-Methyl-DL-valine | EN300-206248 | SCHEMBL62852 | Isovaline, 3-methyl- | FT-067

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

Pubchem Sid

504757978

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504757978

Sonrisas canónicas

CC(C)C(C)(C(=O)O)N

IUPAC Name

2-amino-2,3-dimethylbutanoic acid

InChIKey

GPYTYOMSQHBYTK-UHFFFAOYSA-N

INCHI

1S/C6H13NO2/c1-4(2)6(3,7)5(8)9/h4H,7H2,1-3H3,(H,8,9)

Isómeros SMILES

CC(C)C(C)(C(=O)O)N

Peso molecular

131.17

Reaxy-Rn

1702631

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1702631&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 Alpha amino acids and derivatives
            • Level7 Alpha amino acids

• 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 - Alpha amino acids and derivatives
• Direct Parent: Alpha amino acids
• Alternative Parents: Methyl-branched fatty acids Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Alpha-amino acid - Branched fatty acid - Methyl-branched fatty acid - Fatty acid - Fatty acyl - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Organopnictogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Primary aliphatic amine - Carbonyl group - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
• External Descriptors: Not available

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

Propiedades químicas y físicas

• Peso molecular: 131.170 g/mol
• XLogP3: -1.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 131.095 Da
• Monoisotopic Mass: 131.095 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 122.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 1
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Preguntas frecuentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 26287-62-7, the molecular formula is C6H13NO2, and the molecular weight is 131.17 g/mol. InChIKey GPYTYOMSQHBYTK-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.