ácido 1-Boc-4-aminopiperidina-4-carboxílico - ≥97% , CAS No.183673-71-4

CAS: 183673-71-4 Cat. No.: B119056 Peso molecular: 244.29 Número EC: 675-662-2

GRADE & PURITY ≥97%

Synonyms

A1-01785 | IDI1_011390 | BS-9753 | 1,4-Piperidinedicarboxylic acid,4-amino-,1-tert-butyl ester | 4-amino-1-boc-isonipecotic acid | DTXSID90351230 | EN300-184105 | MENTHYLSALICYLATE | SR-01000003312-1 | SR-01000003312 | YNHLVALLAURVJF-UHFFFAOYSA-N | FT-061

Storage

Protected from light,Room temperature

Shipped In

Normal

Descripción general

el Ácido 1-Boc-4-aminopiperidina-4-carboxílico es un compuesto aminoácido a base de piperidina protegido con Boc. el ácido 1-Boc-4-aminopiperidina-4-carboxílico es un fragmento útil para la síntesis y se ha descrito su utilidad en la preparación de péptidos helicoidales solubles en agua.
Participa en investigaciones de los efectos conformacionales sobre la eficacia de la transferencia de electrones en los plegadores peptídicos.Reactivo para la síntesis de: Inhibidores de SIRT2 Antagonistas del receptor 1 de la hormona concentradora de melanina Antagonistas del receptor hB2 de la bradiquinina Ligandos del receptor 1 de la neuroquinina

Specifications

Sinónimos

A1-01785 | IDI1_011390 | BS-9753 | 1, 4-Piperidinedicarboxylic acid, 4-amino-, 1-tert-butyl ester | 4-amino-1-boc-isonipecotic acid | DTXSID90351230 | EN300-184105 | MENTHYLSALICYLATE | SR-01000003312-1 | SR-01000003312 | YNHLVALLAURVJF-UHFFFAOYSA-N | FT-061

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488191167
• Sonrisas canónicas: CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)N
• IUPAC Name: 4-amino-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidine-4-carboxylic acid
• InChIKey: YNHLVALLAURVJF-UHFFFAOYSA-N
• INCHI: 1S/C11H20N2O4/c1-10(2,3)17-9(16)13-6-4-11(12,5-7-13)8(14)15/h4-7,12H2,1-3H3,(H,14,15)
• Isómeros SMILES: CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)O)N
• WGK Alemania: 3
• Peso molecular: 244.29
• Reaxy-Rn: 7588844
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=7588844&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
              • Level8 L-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 - Alpha amino acids
• Direct Parent: L-alpha-amino acids
• Alternative Parents: D-alpha-amino acids Piperidinecarboxylic acids Aminopiperidines Carbamate esters Organic carbonic acids and derivatives Amino acids Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: L-alpha-amino acid - D-alpha-amino acid - Piperidinecarboxylic acid - 4-aminopiperidine - Piperidine - Carbamic acid ester - Carbonic acid derivative - Amino acid - Carboxylic acid - Monocarboxylic acid or derivatives - Azacycle - Organoheterocyclic compound - Amine - Primary amine - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organic oxide - Organopnictogen compound - Primary aliphatic amine - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as l-alpha-amino acids. These are alpha amino acids which have the L-configuration of the alpha-carbon atom.
• 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

• Solubilidad: Soluble in water, and methanol
• Sensibilidad: light sensitive
• Punto de fusión (°C): 289-294°C
• Peso molecular: 244.290 g/mol
• XLogP3: -2.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 244.142 Da
• Monoisotopic Mass: 244.142 Da
• Topological Polar Surface Area: 92.900 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 314.000
• 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