H-Pyr-OH - ≥99% , CAS No.98-79-3

CAS: 98-79-3 Cat. No.: P106004 Summenformel: C₅H₇NO₃ Molekulargewicht: 129.11 Beilstein Registry Number: 82132 EG-Nummer: 202-700-3

GRADE & PURITY ≥99%

Synonyms

L-5-Oxo-2-pyrrolidinecarboxylic acid | L-Pyrrolidinonecarboxylate | MLS001332421 | DTXCID4026260 | pyrrolidone car-boxylic acid | (S)-5-Oxopyrrolidine-2-carboxylic Acid | 2-Benzothiazolesulfenic acid morpholide | (-)-Pyroglutamate | (S)-(-)-2-Pyrrolidone-

Storage

Argon charged,Room temperature

Shipped In

Normal

Übersicht

L-Pyroglutamic acid is a building block for pharmaceuticals and asymmetric synthesis.
A building block for pharmaceuticals and asymmetric synthesis

Specifications

Synonyme

L-5-Oxo-2-pyrrolidinecarboxylic acid | L-Pyrrolidinonecarboxylate | MLS001332421 | DTXCID4026260 | pyrrolidone car-boxylic acid | (S)-5-Oxopyrrolidine-2-carboxylic Acid | 2-Benzothiazolesulfenic acid morpholide | (-)-Pyroglutamate | (S)-(-)-2-Pyrrolidone-

Spezifikationen & Reinheit

≥99%

Storage

Argon charged,Room temperature

Verschickt in

Normal

Reinheit

≥99%

Namen und Kennungen

• Pubchem Sid: 504751332
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504751332
• Kanonisches Lächeln: C1CC(=O)NC1C(=O)O
• IUPAC Name: (2S)-5-oxopyrrolidine-2-carboxylic acid
• InChIKey: ODHCTXKNWHHXJC-VKHMYHEASA-N
• INCHI: 1S/C5H7NO3/c7-4-2-1-3(6-4)5(8)9/h3H,1-2H2,(H,6,7)(H,8,9)/t3-/m0/s1
• Isomere SMILES: C1CC(=O)N[C@@H]1C(=O)O
• WGK Deutschland: 3
• RTECS: TW3710000
• Molekulargewicht: 129.11
• Beilstein: 82132
• Reaxy-Rn: 82131
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=82131&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Klasse Carboxylic acids and derivatives
      • Subclass Amino acids, peptides, and analogues
        • Ebene5 Amino acids and derivatives
          • Ebene6 Alpha amino acids and derivatives

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Klasse: Carboxylic acids and derivatives
• Subclass: Amino acids, peptides, and analogues
• Intermediate Tree Nodes: Amino acids and derivatives
• Direct Parent: Alpha amino acids and derivatives
• Alternative Parents: Pyrroline carboxylic acids Cyclic carboximidic acids Lactims Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Carboxylic acids Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Alpha-amino acid or derivatives - Pyrroline carboxylic acid - Pyrroline carboxylic acid or derivatives - Pyrroline - Cyclic carboximidic acid - Lactim - Carboxylic acid - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Azacycle - Organoheterocyclic compound - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as alpha amino acids and derivatives. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon), or a derivative thereof.
• External Descriptors: Other amino acids

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

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Phytophthora infestans (820 Activities)

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Plasmodium falciparum (966862 Activities)

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Plasmodium berghei (192651 Activities)

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Mus musculus (284745 Activities)

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Rattus norvegicus (775804 Activities)

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rep Replicase polyprotein 1ab (378 Activities)

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Pseudoperonospora cubensis (1623 Activities)

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Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water (10-15% at 20 °C), alcohol, acetone, DMSO, and methanol.
• Empfindlichkeit: Hygroscopic
• Spezifische Drehung [α]: -10 ° (C=5, H2O)
• Schmelzpunkt (°C): 152-162°C
• Molekulargewicht: 129.110 g/mol
• XLogP3: -0.800
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 129.043 Da
• Monoisotopic Mass: 129.043 Da
• Topological Polar Surface Area: 66.400 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 154.000
• 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

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 98-79-3, the molecular formula is C5H7NO3, and the molecular weight is 129.11 g/mol. InChIKey ODHCTXKNWHHXJC-VKHMYHEASA-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.