4,5-Dicyanoimidazole
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4,5-Dicyanoimidazole
structure -
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CAS No:
1122-28-7
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Formula:
C5H2N4
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Chemical Name:
4,5-Dicyanoimidazole
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Synonyms:
1H-Imidazole-4,5-dicarbonitrile;Imidazole-4,5-dicarbonitrile;4,5-Dicyanoimidazole;MOA 7;NSC 113954;2H-Imidazole-4,5-dicarbonitrile;745818-57-9;1438465-24-7
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CAS No:
4,5-Dicyanoimidazole Basic Attributes
118.1
118.10
118208
214-344-6
AZ5X73C3CC
113954
DTXSID00149943
2933290090
Characteristics
76.3
0.2
solid white Crystalline Powder
1.4±0.1 g/cm3
175 °C
569.3ºC at 760 mmHg
50 °F
1.584
soluble in Acetonitrile: 1.8g/10ml, DMSO, Methanol.
Store below +30°C.
5.65E-13mmHg at 25°C
Safety Information
III
6.1
UN 1648 3/PG 2
3
37/38-41-36/37/38-20/22-36-20/21/22-11
26-39-36/37/39-36/37-16
Xi,Xn,F
Irritant
P261-P280-P305 + P351 + P338
H315-H318-H335
|Danger|H302 (23.64%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 55 companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:118.10
XLogP3:0.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Exact Mass:118.027946081
Monoisotopic Mass:118.027946081
Topological Polar Surface Area:76.3
Heavy Atom Count:9
Complexity:192
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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