(R)-(−)-Pyrrolidine-3-carboxylic acid - ≥97% , CAS No.72580-54-2

CAS: 72580-54-2 Cat. No.: S134732 Peso molecular: 115.13 Beilstein Registry Number: 5496140 Número EC: 806-876-8 PubChem CID: 1501970

GRADE & PURITY ≥97%

Synonyms

D-pyrrolidine-3-carboxylic acid | (3R)-3-PYRROLIDINECARBOXYLIC ACID | SCHEMBL825587 | (R)-Pyrrolidine-3-carboxylicacid | JAEIBKXSIXOLOL-SCSAIBSYSA-N | HY-60256 | AM20100694 | (R)-ss-Proline | (R)-(-)-Pyrrolidine-3-carboxylic acid | (R)-pyrrolidine-3-carbo

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Sinónimos

D-pyrrolidine-3-carboxylic acid | (3R)-3-PYRROLIDINECARBOXYLIC ACID | SCHEMBL825587 | (R)-Pyrrolidine-3-carboxylicacid | JAEIBKXSIXOLOL-SCSAIBSYSA-N | HY-60256 | AM20100694 | (R)-ss-Proline | (R)-(-)-Pyrrolidine-3-carboxylic acid | (R)-pyrrolidine-3-carbo

Especificaciones y pureza

≥97%

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

≥97%

Nombres e identificadores

• Pubchem Sid: 488191867
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488191867
• Sonrisas canónicas: C1CNCC1C(=O)O
• IUPAC Name: (3R)-pyrrolidine-3-carboxylic acid
• InChIKey: JAEIBKXSIXOLOL-SCSAIBSYSA-N
• INCHI: 1S/C5H9NO2/c7-5(8)4-1-2-6-3-4/h4,6H,1-3H2,(H,7,8)/t4-/m1/s1
• Isómeros SMILES: C1CNC[C@@H]1C(=O)O
• WGK Alemania: 3
• PubChem CID: 1501970
• Peso molecular: 115.13
• Beilstein: 5496140

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Pyrrolidines
      • Subclass Pyrrolidine carboxylic acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Pyrrolidines
• Subclass: Pyrrolidine carboxylic acids and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyrrolidine carboxylic acids
• Alternative Parents: 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: Pyrrolidine carboxylic acid - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Secondary aliphatic amine - Monocarboxylic acid or derivatives - Azacycle - Secondary amine - Amine - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Carbonyl group - Organic nitrogen compound - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as pyrrolidine carboxylic acids. These are compounds containing a pyrrolidine ring which bears a carboxylic acid. Pyrrolidine is a five-membered saturated aliphatic heterocycle with one nitrogen atom and four carbon atoms.
• 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: 115.130 g/mol
• XLogP3: -3.200
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 115.063 Da
• Monoisotopic Mass: 115.063 Da
• Topological Polar Surface Area: 49.300 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 103.000
• 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