4,5-Dicyanoimidazole(DCI) - ≥98% , CAS No.1122-28-7

CAS: 1122-28-7 Cat. No.: D109319 Peso molecular: 118.1 Beilstein Registry Number: 118208 Número EC: 214-344-6

GRADE & PURITY ≥98%

Synonyms

DCI | SCHEMBL20204 | 4,5-Dicyanoimidazole | DTXSID00149943 | HY-W001962 | AMY23389 | F3308-1854 | UNII-AZ5X73C3CC | 1H-imidazol-4,5-dikohlenitrile | D2026 | 4,5-DICYANOIMIDAZOLE in anhydrous acetonitril | 4,5-Dicyanoimidazole, 95% | AC-3058 | Nickel(II) i

Storage

Store at 2-8°C,Desiccated

Shipped In

Wet ice

Descripción general

product description：

4,5-Dicyanoimidazole (DCI) participates as an activator in the synthesis of oligonucleotides.

application：

4,5-Dicyanoimidazole may be used to synthesize:

5′-O-(4,4′-dimethoxytrityl)-2′-deoxythymidine 3′-O-(2-cyanoethyl N,N-diisopropylphosphoramidite)

4,5-di(amidoximyl)imidazole [4,5-(DAO)Im]

1-(4-methoxybenzyl)-4,5-dicyanoimidazole

novel imidazo[4 5-e][1 3]diazepine analog

N-benzyl-4,5-dicyanoimidazole] 

Specifications

Sinónimos

DCI | SCHEMBL20204 | 4, 5-Dicyanoimidazole | DTXSID00149943 | HY-W001962 | AMY23389 | F3308-1854 | UNII-AZ5X73C3CC | 1H-imidazol-4, 5-dikohlenitrile | D2026 | 4, 5-DICYANOIMIDAZOLE in anhydrous acetonitril | 4, 5-Dicyanoimidazole, 95% | AC-3058 | Nickel(II) i

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Store at 2-8°C, Desiccated

Enviado en

Wet ice

Este producto requiere envío en cadena de frío. Los servicios terrestres y otros servicios económicos no están disponibles.

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1=NC(=C(N1)C#N)C#N
• IUPAC Name: 1H-imidazole-4,5-dicarbonitrile
• InChIKey: XGDRLCRGKUCBQL-UHFFFAOYSA-N
• INCHI: 1S/C5H2N4/c6-1-4-5(2-7)9-3-8-4/h3H,(H,8,9)
• Isómeros SMILES: C1=NC(=C(N1)C#N)C#N
• WGK Alemania: 3
• Peso molecular: 118.1
• Beilstein: 118208
• Reaxy-Rn: 118208
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=118208&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Clase Azoles
      • Subclass Imidazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Clase: Azoles
• Subclass: Imidazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Imidazoles
• Alternative Parents: Heteroaromatic compounds Nitriles Azacyclic compounds Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Imidazole - Azacycle - Nitrile - Carbonitrile - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as imidazoles. These are compounds containing an imidazole ring, which is an aromatic five-member ring with two nitrogen atoms at positions 1 and 3, and three 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 Acetonitrile: 1.8g/10ml, DMSO, Methanol.
• Punto de fusión (°C): 168-175°C
• Peso molecular: 118.100 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 118.028 Da
• Monoisotopic Mass: 118.028 Da
• Topological Polar Surface Area: 76.300 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 191.000
• 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: 1

Referencias

1. Zijun Ding, Xiaoying Gao, Yanmei Yang, Hua Wei, Shenghong Yang, Jian Liu.  (2023)  Amorphous copper(II)-cyanoimidazole frameworks as peroxidase mimics for hydrogen sulfide assay.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:37690296] [10.1016/j.jcis.2023.09.014]

2. Gaopeng Liu, Keke Wang, Lin Wang, Bin Wang, Zixia Lin, Xin Chen, Yingjie Hua, Wenshuai Zhu, Huaming Li, Jiexiang Xia.  (2020)  A Janus cobalt nanoparticles and molybdenum carbide decorated N-doped carbon for high-performance overall water splitting.  JOURNAL OF COLLOID AND INTERFACE SCIENCE,      [PMID:33039860] [10.1016/j.jcis.2020.09.007]

3. Dan Li, Yong Kang, Jie Li, Zongchi Wang, Zhinan Yan, Kai Sheng.  (2020)  Chemically tunable DILs: Physical properties and highly efficient capture of low-concentration SO2.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2020.116572]

4. Guangli Yu, Ziyang Wang, Junchao Dong, Fei Ni, Dandan Song, Terence Xiaoteng Liu, Zhanhui Yuan, Kangjun Wang, Xiaoqin Zou.  (2025)  A zeolitic imidazolate framework with uncoordinated cyano groups in mixed matrix membranes for efficient propylene/propane separation.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2025.159352]

5. Hua Wei, Jian Liu, Xin Wang, Zihan Li, Lijuan Ju, Boxuan Yao, Jiarui Zhou, Lei Zhao, Mingyang Zhou, Jie Zhang, Shenghong Yang.  (2023)  Secondary metal doped cuprous-cyanoimidazole frameworks for triple-mode detection of dopamine.  ANALYTICA CHIMICA ACTA,      [PMID:37827638] [10.1016/j.aca.2023.341798]