L-tert-leucinaMide hydrochloride - ≥98% , CAS No.75158-12-2

CAS: 75158-12-2 Cat. No.: L304556 Peso molecular: 166.65 Número EC: 888-548-4

GRADE & PURITY ≥98%

Synonyms

(S)-2-Amino-3,3-dimethylbutanamide hydrochloride | S02ZHK1QN8 | L-Tert-Leucinamide HCl | (S)-2-Amino-3,3-dimethylbutanamidehydrochloride | (2S)-2-amino-3,3-dimethylbutanamide;hydrochloride | tert-Leucinamide hydrochloride, L- | DS-8439 | UNII-S02ZHK1QN8 |

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

(S)-2-Amino-3, 3-dimethylbutanamide hydrochloride | S02ZHK1QN8 | L-Tert-Leucinamide HCl | (S)-2-Amino-3, 3-dimethylbutanamidehydrochloride | (2S)-2-amino-3, 3-dimethylbutanamide;hydrochloride | tert-Leucinamide hydrochloride, L- | DS-8439 | UNII-S02ZHK1QN8 |

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C

Enviado en

Wet ice

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

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 504771811
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504771811
• Sonrisas canónicas: CC(C)(C)C(C(=O)N)N.Cl
• IUPAC Name: (2S)-2-amino-3,3-dimethylbutanamide;hydrochloride
• InChIKey: ZTHDYUDIZSIFRY-PGMHMLKASA-N
• INCHI: 1S/C6H14N2O.ClH/c1-6(2,3)4(7)5(8)9;/h4H,7H2,1-3H3,(H2,8,9);1H/t4-;/m1./s1
• Isómeros SMILES: CC(C)(C)[C@@H](C(=O)N)N.Cl
• Peso molecular: 166.65
• Reaxy-Rn: 3912098
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3912098&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 Valine 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 - Alpha amino acids and derivatives
• Direct Parent: Valine and derivatives
• Alternative Parents: Fatty amides Carboxylic acid amides Organopnictogen compounds Organooxygen compounds Organic oxides Monoalkylamines Hydrochlorides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Valine or derivatives - Fatty acyl - Fatty amide - Carboxamide group - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrochloride - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Aliphatic acyclic compound
• Descripción: This compound belongs to the class of organic compounds known as valine and derivatives. These are compounds containing valine or a derivative thereof resulting from reaction of valine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• 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: 166.650 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 166.087 Da
• Monoisotopic Mass: 166.087 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 115.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 1
• 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: 2

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