5-AVABr - ≥99.5%(4 Times Purification) , CAS No.2173111-73-2

CAS: 2173111-73-2 Cat. No.: A491891 Summenformel: C₅H₁₁NO₂•HBr Molekulargewicht: 198.06 EG-Nummer: 836-093-7

GRADE & PURITY ≥99.5%(4 Times Purification)

Synonyms

Homopiperidinic Acid Hydrobromide | MFCD30721937 | 5-Aminovaleric Acid Hydrobromide (Low water content) | 5-Aminovaleric Acid Hydrobromide | F88623 | 2173111-73-2 | 5-Aminopentanoic Acid Hydrobromide | 5-aminopentanoic acid;hydrobromide | 5-Aminopentanoic

Storage

Protected from light,Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyme

Homopiperidinic Acid Hydrobromide | MFCD30721937 | 5-Aminovaleric Acid Hydrobromide (Low water content) | 5-Aminovaleric Acid Hydrobromide | F88623 | 2173111-73-2 | 5-Aminopentanoic Acid Hydrobromide | 5-aminopentanoic acid;hydrobromide | 5-Aminopentanoic

Spezifikationen & Reinheit

≥99.5%(4 Times Purification)

Storage

Protected from light,Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥99.5%(4 Times Purification)

Namen und Kennungen

• Pubchem Sid: 504773117
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504773117
• Kanonisches Lächeln: C(CCN)CC(=O)O.Br
• IUPAC Name: 5-aminopentanoic acid;hydrobromide
• InChIKey: ZLNATNZPOLTKHA-UHFFFAOYSA-N
• INCHI: 1S/C5H11NO2.BrH/c6-4-2-1-3-5(7)8;/h1-4,6H2,(H,7,8);1H
• Isomere SMILES: C(CCN)CC(=O)O.Br
• Molekulargewicht: 198.06
• Reaxy-Rn: 36938022
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=36938022&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 Delta 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: Delta amino acids and derivatives
• Alternative Parents: Straight chain fatty acids Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organooxygen compounds Organic oxides Monoalkylamines Hydrocarbon derivatives Hydrobromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Delta amino acid or derivatives - Fatty acyl - Fatty acid - Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Hydrobromide - Organooxygen compound - Organonitrogen compound - Primary aliphatic amine - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as delta amino acids and derivatives. These are compounds containing a carboxylic acid group and an amino group at the C5 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in DMF, DMSO et al
• Empfindlichkeit: Moisture sensitive；air sensitive；light sensitive
• Molekulargewicht: 198.060 g/mol
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 197.005 Da
• Monoisotopic Mass: 197.005 Da
• Topological Polar Surface Area: 63.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 72.800
• 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: 2

XLogP3