ChemicalBook--->CAS DataBase List--->1122-28-7

1122-28-7

1122-28-7 Structure

1122-28-7 Structure
IdentificationMore
[Name]

1H-Imidazole-4,5-dicarbonitrile
[CAS]

1122-28-7
[Synonyms]

1h-imidazole-4,5-dicarbonitrile
4,5-DICYANOIMIDAZOLE
4,5-IMIDAZOLEDICARBONITRILE
ACTIVATOR
AURORA 15196
DCI
IMIDAZOLE-4,5-DICARBONITRILE
4,5-DICYANOIMIDAZOL
4,5-Dicyanoimidazole, 99.0%
4,5-Dicyanoimidazole 1000g, Single
4,5-DICYANOIMIDAZOLE, 0.25M IN ACETONIT&
4,5-Dicyanoimidazole 100g, Single
Dci(4,5-Dicyanoimidazole)
4,5-Dicyanoimidazole95%
Dci.4,5-Dicyanoimidazole,C5H2N4
Dicyanoimidazole
1H-Imidazole-4,5-dicarbonitrile 99%
4,5-Dicyano-1H-imidazole
4,5-DICCYANOIMIDAZOLE
4,5-DICYANOIMIDAZOLE (DCI)
[EINECS(EC#)]

214-344-6
[Molecular Formula]

C5H2N4
[MDL Number]

MFCD00005194
[Molecular Weight]

118.1
[MOL File]

1122-28-7.mol
Chemical PropertiesBack Directory
[Appearance]

White to off white crystalline powder.
[Melting point ]

168-175 °C(lit.)
[Boiling point ]

569.3±35.0 °C(Predicted)
[density ]

0.791 g/mL at 25 °C
[Fp ]

50 °F
[storage temp. ]

Inert atmosphere,Room Temperature
[solubility ]

Soluble in Acetonitrile: 1.8g/10ml, DMSO, Methanol.
[form ]

Crystalline Powder
[pka]

5.01±0.10(Predicted)
[color ]

solid white
[Detection Methods]

HPLC
[BRN ]

118208
[InChI]

InChI=1S/C5H2N4/c6-1-4-5(2-7)9-3-8-4/h3H,(H,8,9)
[InChIKey]

XGDRLCRGKUCBQL-UHFFFAOYSA-N
[SMILES]

C1NC(C#N)=C(C#N)N=1
[CAS DataBase Reference]

1122-28-7(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)Exclamation Mark (GHS07)
GHS05,GHS07
[Signal word ]

Danger
[Hazard statements ]

H315-H318-H335
[Precautionary statements ]

P261-P280-P305+P351+P338
[Hazard Codes ]

Xi,Xn,F
[Risk Statements ]

R37/38:Irritating to respiratory system and skin .
R41:Risk of serious damage to eyes.
R36/37/38:Irritating to eyes, respiratory system and skin .
R20/22:Harmful by inhalation and if swallowed .
R36:Irritating to the eyes.
R20/21/22:Harmful by inhalation, in contact with skin and if swallowed .
R11:Highly Flammable.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S39:Wear eye/face protection .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S36/37:Wear suitable protective clothing and gloves .
[RIDADR ]

UN 1648 3/PG 2
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HazardClass ]

6.1
[PackingGroup ]

III
[HS Code ]

29332900
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Dam. 1
Skin Irrit. 2
STOT SE 3
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Triethyl orthoformate-->Anisole-->Diaminomaleonitrile-->Temozolomide Impurity 16-->2,3-Diaminobut-2-enedinitrile-->5-Amino-1H-imidazol-4-carbonitrile
[Preparation Products]

4,5-Imidazoledicarboxylic acid-->2-Bromo-1H-imidazole-4,5-dicarbonitrile-->1H-Imidazole-4,5-dicarbonitrile, 1-ethyl-
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

1H-Imidazole-4,5-dicarbonitrile(1122-28-7).msds
Hazard InformationBack Directory
[Chemical Properties]

white crystalline powder
[Uses]

4,5-Dicyanoimidazole is used in activation of nucleoside phosphoramidites during solid-phase oligonucleotide synthesis, and synthesis of nucleoside phosphoramidites, synthesis of novel nucleosides. It is often used as an alternative to tetrazole.
[Synthesis Reference(s)]

Synthesis, p. 767, 1988 DOI: 10.1055/s-1988-27702
[General Description]

4,5-Dicyanoimidazole (DCI) participates as an activator in the synthesis of oligonucleotides.
Spectrum DetailBack Directory
[Spectrum Detail]

4,5-Dicyanoimidazole(1122-28-7)MS
4,5-Dicyanoimidazole(1122-28-7)1HNMR
4,5-Dicyanoimidazole(1122-28-7)13CNMR
4,5-Dicyanoimidazole(1122-28-7)IR1
4,5-Dicyanoimidazole(1122-28-7)IR2
4,5-Dicyanoimidazole(1122-28-7)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4,5-Dicyanoimidazole, 99%(1122-28-7)
[Alfa Aesar]

4,5-Dicyanoimidazole, 98+%(1122-28-7)
[Sigma Aldrich]

1122-28-7(sigmaaldrich)
[TCI AMERICA]

4,5-Dicyanoimidazole,>98.0%(LC)(N)(1122-28-7)
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