Piperazine Dihydrobromide - ≥98%(N) , CAS No.59813-05-7

CAS: 59813-05-7 Cat. No.: P160723 Summenformel: C₄H₁₀N₂·2HBr Molekulargewicht: 247.96 EG-Nummer: 261-937-0 PubChem CID: 3017157

QUALITÄT & REINHEIT ≥98%(N)

Synonyms

Piperazinium Bromide | Piperazinium Dibromide

Storage

Room temperature,Argon charged

Shipped In

Normal

Spezifikationen

Synonyme

Piperazinium Bromide | Piperazinium Dibromide

Spezifikationen & Reinheit

≥98%(N)

Storage

Room temperature,Argon charged

Verschickt in

Normal

Reinheit

≥98%(N)

Namen und Kennungen

Pubchem Sid

488194169

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488194169

Kanonisches Lächeln

C1CNCCN1.Br.Br

IUPAC Name

piperazine;dihydrobromide

InChIKey

UXWKNNJFYZFNDI-UHFFFAOYSA-N

INCHI

1S/C4H10N2.2BrH/c1-2-6-4-3-5-1;;/h5-6H,1-4H2;2*1H

Isomere SMILES

C1CNCCN1.Br.Br

PubChem CID

3017157

Molekulargewicht

247.96

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Diazinanes
      • Subclass Piperazines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Diazinanes
• Subclass: Piperazines
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperazines
• Alternative Parents: Dialkylamines Azacyclic compounds Hydrocarbon derivatives Hydrobromides
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Piperazine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Hydrocarbon derivative - Hydrobromide - Organonitrogen compound - Amine - Aliphatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as piperazines. These are compounds containing a piperazine ring, which is a saturated aliphatic six-member heterocyclic with two nitrogen atoms at positions 1 and 4, as well as 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

Chemische und physikalische Eigenschaften

• Löslichkeit: Soluble in water
• Empfindlichkeit: Moisture sensitive.
• Schmelzpunkt (°C): 360 °C(dec.)
• Molekulargewicht: 247.960 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 247.935 Da
• Monoisotopic Mass: 245.937 Da
• Topological Polar Surface Area: 24.100 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 26.500
• 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: 3

XLogP3