D-Homoproline - ≥99% , CAS No.1723-00-8

CAS: 1723-00-8 Cat. No.: H100528 Fórmula: C₆H₁₁NO₂ Peso molecular: 129.16 Beilstein Registry Number: 81094 Número CE: 217-024-4

GRADE & PURITY ≥99%

Synonyms

(+)-Pipecolinic acid | D-(+)-Pipercolic acid | D-piperidine-2-carboxylic acid | (R)-Piperidine-2-carboxylic acid | (R)-2-CARBOXYPIPERIDINE | 2-(R)-piperidine carboxylic acid | D-(+)- Pipecolic acid | DS-1095 | AKOS005258386 | D-hPro-OH | h-d-hopro-oh | (R

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

(+)-Pipecolinic acid | D-(+)-Pipercolic acid | D-piperidine-2-carboxylic acid | (R)-Piperidine-2-carboxylic acid | (R)-2-CARBOXYPIPERIDINE | 2-(R)-piperidine carboxylic acid | D-(+)- Pipecolic acid | DS-1095 | AKOS005258386 | D-hPro-OH | h-d-hopro-oh | (R

Especificações e pureza

≥99%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥99%

Nomes e identificadores

Pubchem Sid

488191346

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488191346

Sorrisos canónicos

C1CCNC(C1)C(=O)O

IUPAC Name

(2R)-piperidine-2-carboxylic acid

InChIKey

HXEACLLIILLPRG-RXMQYKEDSA-N

INCHI

1S/C6H11NO2/c8-6(9)5-3-1-2-4-7-5/h5,7H,1-4H2,(H,8,9)/t5-/m1/s1

SMILES isoméricas

C1CCN[C@H](C1)C(=O)O

WGK Alemanha

3

Peso molecular

129.16

Beilstein

81094

Reaxy-Rn

81095

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=81095&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe 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 D-alpha-amino acids

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: 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: D-alpha-amino acids
• Alternative Parents: Piperidinecarboxylic acids Amino acids Monocarboxylic acids and derivatives Dialkylamines Carboxylic acids Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: D-alpha-amino acid - Piperidinecarboxylic acid - Piperidine - Amino acid - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Secondary amine - Organoheterocyclic compound - Azacycle - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Amine - Carbonyl group - Organopnictogen compound - Hydrocarbon derivative - Organic oxide - Aliphatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as d-alpha-amino acids. These are alpha amino acids which have the D-configuration of the alpha-carbon atom.
• External Descriptors: pipecolic 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 ação

Propriedades químicas e físicas

• Rotação específica [α]: 27 ° (C=1, H2O)
• Ponto de fusão (°C): 277°C
• Peso molecular: 129.160 g/mol
• XLogP3: -2.300
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 129.079 Da
• Monoisotopic Mass: 129.079 Da
• Topological Polar Surface Area: 49.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 114.000
• 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