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CAS No.: | 7242-15-1 |
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Name: | benzimidazole,copper,formic acid,dihydrate |
Molecular Structure: | |
Formula: | C16H20Cu2N4O6 |
Molecular Weight: | 491.4452 |
Synonyms: | benzimidazole; copper; formic acid; dihydrate;1H-benzimidazole; copper; formic acid; dihydrate; |
Boiling Point: | 360 °C at 760 mmHg |
Flash Point: | 208.4 °C |
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The 1H-benzoimidazole; copper; formic acid; dihydrate, with the CAS registry number 7242-15-1, has the systematic name of benzimidazole; copper; formic acid; dihydrate. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C16H20Cu2N4O6.
The characteristics of 1H-benzoimidazole; copper; formic acid; dihydrate are as followings: (1)ACD/LogP: 1.39; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 17.82 Å2; (7)Flash Point: 208.4 °C; (8)Enthalpy of Vaporization: 58.18 kJ/mol; (9)Boiling Point: 360 °C at 760 mmHg; (10)Vapour Pressure: 4.74E-05 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Cu].[Cu].O=CO.O=CO.n2c1ccccc1nc2.O.O.n2c1ccccc1nc2
(2)InChI: InChI=1/2C7H6N2.2CH2O2.2Cu.2H2O/c2*1-2-4-7-6(3-1)8-5-9-7;2*2-1-3;;;;/h2*1-5H,(H,8,9);2*1H,(H,2,3);;;2*1H2
(3)InChIKey: FFLOJSSIQJILSE-UHFFFAOYAJ