Cas no 55299-95-1 (1H-benzodimidazol-5-amine dihydrochloride)

1H-Benzimidazol-5-amine dihydrochloride is a chemically stable, water-soluble derivative of benzimidazole, widely utilized in pharmaceutical and organic synthesis applications. Its dihydrochloride salt form enhances solubility, facilitating precise dosing in research and industrial processes. The compound serves as a key intermediate in the synthesis of bioactive molecules, particularly in the development of antimicrobial and antitumor agents. Its high purity and consistent composition ensure reliable performance in complex reactions. The hydrochloride groups improve handling and storage stability, making it suitable for long-term use. This reagent is valued for its versatility in heterocyclic chemistry and its role in advancing medicinal chemistry research.
1H-benzodimidazol-5-amine dihydrochloride structure
55299-95-1 structure
Product Name:1H-benzodimidazol-5-amine dihydrochloride
CAS No:55299-95-1
MF:C7H9Cl2N3
MW:206.072458982468
MDL:MFCD00465258
CID:56737
PubChem ID:17385557
Update Time:2025-11-06

1H-benzodimidazol-5-amine dihydrochloride Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzo[d]imidazol-6-amine dihydrochloride
    • 1H-1,3-Benzimidazol-5-amine
    • 1H-BENZOIMIDAZOL-5-YLAMINE
    • 1H-Benzoimidazol-5-ylamine dihydrochloride
    • 3H-benzimidazol-5-amine
    • 5-AMINO BENZIMIDAZOLE
    • 5-Aminobenzimidazole hydrochloride
    • 1(3)H-Benzimidazol-5-ylamin, Dihydrochlorid
    • 1(3)H-benzimidazol-5-ylamine, dihydrochloride
    • 1H-BENZIMIDAZOL-5-YLAMINE
    • 1H-benzo[d]imidazol-5-amine
    • 5(6)-aminobenzimidazole dihydrochloride
    • 5-aminobenzimidazole dihydrochloride
    • Nsc11998
    • 1H-benzo[d]imidazol-5-amine dihydrochloride
    • 1H-Benzo[d]imidazol-6-aminedihydrochloride
    • CS-0155724
    • EN300-34513
    • D82562
    • 1H-Benzimidazol-5-amine dihydrochloride, AldrichCPR
    • 1H-1,3-benzodiazol-5-amine dihydrochloride
    • AKOS022185018
    • 3H-benzimidazol-5-amine;dihydrochloride
    • 1H-benzoimidazol-5-ylaminedihydrochloride
    • MFCD00726702
    • AKOS015845605
    • SCHEMBL9450655
    • 55299-95-1
    • 5-aminobenzimidazole 2HCl
    • 1H-benzodimidazol-5-amine dihydrochloride
    • MDL: MFCD00465258
    • Inchi: 1S/C7H7N3.2ClH/c8-5-1-2-6-7(3-5)10-4-9-6;;/h1-4H,8H2,(H,9,10);2*1H
    • InChI Key: KGUVDDLDXKLQDZ-UHFFFAOYSA-N
    • SMILES: Cl.Cl.N1C=NC2C=CC(=CC1=2)N

Computed Properties

  • Exact Mass: 169.04084
  • Monoisotopic Mass: 169.041
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 0
  • Complexity: 126
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: nothing
  • Topological Polar Surface Area: 54.7A^2

Experimental Properties

  • Density: 1.4±0.1 g/cm3
  • Melting Point: 95-113°C
  • Boiling Point: 476.1±18.0 °C at 760 mmHg
  • Flash Point: 273.2±8.4 °C
  • PSA: 54.7
  • LogP: 2.52830
  • Vapor Pressure: 0.0±1.2 mmHg at 25°C

1H-benzodimidazol-5-amine dihydrochloride Security Information

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Additional information on 1H-benzodimidazol-5-amine dihydrochloride

Comprehensive Analysis of 1H-Benzodimidazol-5-amine Dihydrochloride (CAS No. 55299-95-1): Properties, Applications, and Research Insights

1H-Benzodimidazol-5-amine dihydrochloride (CAS No. 55299-95-1) is a chemically significant compound widely utilized in pharmaceutical and biochemical research. This dihydrochloride salt derivative of benzimidazole exhibits unique properties that make it valuable for drug development, particularly in targeting enzyme inhibition and molecular signaling pathways. Its heterocyclic structure and amine functionality contribute to its versatility in organic synthesis and medicinal chemistry.

Recent studies highlight the growing interest in 1H-benzodimidazol-5-amine derivatives due to their potential applications in cancer therapeutics and antimicrobial agents. Researchers are actively exploring its role in modulating kinase activity and DNA intercalation, aligning with the current focus on precision medicine. The compound’s solubility in aqueous solutions and stability under physiological conditions further enhance its utility in in vitro assays and high-throughput screening.

From an industrial perspective, 55299-95-1 is often sought after for its use in small-molecule libraries and combinatorial chemistry. Its molecular weight (283.12 g/mol) and purity specifications (>98% HPLC) are critical parameters for reproducibility in experiments. Innovations in green chemistry have also spurred demand for eco-friendly synthesis methods of this compound, addressing sustainability concerns in pharmaceutical manufacturing.

Frequently asked questions about 1H-benzodimidazol-5-amine dihydrochloride include its storage conditions (recommended at 2–8°C), compatibility with organic solvents, and handling precautions. Analytical techniques such as NMR spectroscopy and mass spectrometry are commonly employed to verify its structural integrity. Additionally, its bioavailability and metabolic pathways are subjects of ongoing preclinical research.

The compound’s relevance extends to academic research, where it serves as a building block for peptide conjugates and fluorescent probes. With the rise of AI-driven drug discovery, datasets featuring 55299-95-1 are increasingly used to train algorithms for molecular property prediction. This intersection of chemistry and technology underscores its importance in modern scientific advancements.

In summary, 1H-benzodimidazol-5-amine dihydrochloride (CAS No. 55299-95-1) is a multifaceted compound bridging gaps between basic research and applied science. Its adaptability to diverse experimental needs and alignment with trending topics like personalized medicine and sustainable synthesis ensure its continued prominence in scientific literature and industrial applications.

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