L-Phenylalaninamide - ≥98% , CAS No.5241-58-7

CAS: 5241-58-7 Cat. No.: P105974 Fórmula: C₉H₁₂N₂O Peso molecular: 164.2 Beilstein Registry Number: 6270941 Número EC: 875-163-1

GRADE & PURITY ≥98%

Synonyms

(S)-2-AMINO-3-PHENYL-PROPIONAMIDE | (S)-phenylalaninamide | Z760046820 | AKOS015854038 | EN300-209551 | Phenylalanine amide | Q-102733 | Triethyl(2-((E)-styrylphenoxy)ethyl)ammonium iodide | CARPHENAZINE MALEATE [ORANGE BOOK] | (2S)-2-Amino-3-phenylpropio

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

(S)-2-AMINO-3-PHENYL-PROPIONAMIDE | (S)-phenylalaninamide | Z760046820 | AKOS015854038 | EN300-209551 | Phenylalanine amide | Q-102733 | Triethyl(2-((E)-styrylphenoxy)ethyl)ammonium iodide | CARPHENAZINE MALEATE [ORANGE BOOK] | (2S)-2-Amino-3-phenylpropio

Especificaciones y pureza

≥98%

Mecanismos bioquímicos y fisiológicos

L-Phenylalaninamide is a chiral selector.

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

504758845

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504758845

Sonrisas canónicas

C1=CC=C(C=C1)CC(C(=O)N)N

IUPAC Name

(2S)-2-amino-3-phenylpropanamide

InChIKey

OBSIQMZKFXFYLV-QMMMGPOBSA-N

INCHI

1S/C9H12N2O/c10-8(9(11)12)6-7-4-2-1-3-5-7/h1-5,8H,6,10H2,(H2,11,12)/t8-/m0/s1

Isómeros SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N)N

WGK Alemania

3

Peso molecular

164.2

Beilstein

6270941

Reaxy-Rn

2804067

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2804067&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 Phenylalanine 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: Phenylalanine and derivatives
• Alternative Parents: Alpha amino acid amides Amphetamines and derivatives Aralkylamines Fatty amides Primary carboxylic acid amides Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Phenylalanine or derivatives - Alpha-amino acid amide - Amphetamine or derivatives - Aralkylamine - Monocyclic benzene moiety - Fatty amide - Fatty acyl - Benzenoid - Carboxamide group - Primary carboxylic acid amide - Organic nitrogen compound - Primary amine - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Amine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylalanine and derivatives. These are compounds containing phenylalanine or a derivative thereof resulting from reaction of phenylalanine at the amino group or the carboxy group, or from the replacement of any hydrogen of glycine by a heteroatom.
• External Descriptors: amino acid amide - phenylalanine derivative

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

Objetivos asociados (humanos)

TACR1 Tclin Neurokinin 1 receptor (6273 Activities)

Discover Target: TACR1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mecanismos de acción

Propiedades químicas y físicas

• Punto de fusión (°C): 92.8 °C
• Peso molecular: 164.200 g/mol
• XLogP3: 0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 164.095 Da
• Monoisotopic Mass: 164.095 Da
• Topological Polar Surface Area: 69.100 Ų
• Heavy Atom Count: 12
• Formal Charge: 0
• Complexity: 153.000
• 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: 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 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 5241-58-7, the molecular formula is C9H12N2O, and the molecular weight is 164.2 g/mol. InChIKey OBSIQMZKFXFYLV-QMMMGPOBSA-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.