4-Bromopiperidine hydrobromide - ≥98% , CAS No.54288-70-9

CAS: 54288-70-9 Cat. No.: B123508 Peso molecular: 244.96 Número EC: 628-285-2 PubChem CID: 2734676

GRADE & PURITY ≥98%

Synonyms

Piperidine, 4-bromo-, hydrobromide | AC-23243 | 4-Bromopiperidine hydrobromide (1:1) | GEO-00559 | DTXSID90370441 | EN300-142176 | SB43137 | 4-Bromopiperidinehydrobromide | AS-17553 | LVTIZXGNLIKUQZ-UHFFFAOYSA-N | MFCD00191858 | SY013399 | CL3102 | AKOS00

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

It is a salt of halogenopiperidine. Synthesis of tritium labelled N-aminopiperidine using 4-bromopiperidine as precursor has been reported.
It may be used as a starting material in the synthesis of [2H] piperidine hydrochloride.

Specifications

Sinónimos

Piperidine, 4-bromo-, hydrobromide | AC-23243 | 4-Bromopiperidine hydrobromide (1:1) | GEO-00559 | DTXSID90370441 | EN300-142176 | SB43137 | 4-Bromopiperidinehydrobromide | AS-17553 | LVTIZXGNLIKUQZ-UHFFFAOYSA-N | MFCD00191858 | SY013399 | CL3102 | AKOS00

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥98%

Nombres e identificadores

• Pubchem Sid: 488192646
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488192646
• Sonrisas canónicas: C1CNCCC1Br.Br
• IUPAC Name: 4-bromopiperidine;hydrobromide
• InChIKey: LVTIZXGNLIKUQZ-UHFFFAOYSA-N
• INCHI: 1S/C5H10BrN.BrH/c6-5-1-3-7-4-2-5;/h5,7H,1-4H2;1H
• Isómeros SMILES: C1CNCCC1Br.Br
• WGK Alemania: 3
• PubChem CID: 2734676
• Peso molecular: 244.96
• Reaxy-Rn: 3673002

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Piperidines

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Piperidines
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Piperidines
• Alternative Parents: Dialkylamines Azacyclic compounds Organopnictogen compounds Organobromides Hydrocarbon derivatives Hydrobromides Alkyl bromides
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Piperidine - Azacycle - Secondary amine - Secondary aliphatic amine - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Hydrobromide - Organonitrogen compound - Organobromide - Organohalogen compound - Amine - Alkyl halide - Alkyl bromide - Aliphatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as piperidines. These are compounds containing a piperidine ring, which is a saturated aliphatic six-member ring with one nitrogen atom and five 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

• Solubilidad: Soluble in water
• Punto de fusión (°C): 190.0-194.0°C
• Peso molecular: 244.960 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 244.924 Da
• Monoisotopic Mass: 242.926 Da
• Topological Polar Surface Area: 12.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 50.000
• 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

Referencias

1. Wang Yanrui, Zhang Yaru, Zhang Meng, Jiang Shu, Tang Xiaobin, Liang Heng.  (2025)  Advanced biomimetic nanofiltration membranes for lithium recovery with anti-janus charge structure.  Nature Communications,      [PMID:41397977] [10.1038/s41467-025-66887-2]