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CAS No.: | 1226-43-3 |
---|---|
Name: | BENZOIC 2-BENZOYL-1,2-DIMETHYLHYDRAZIDE |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C16H16N2O2 |
Molecular Weight: | 268.315 |
Synonyms: | Hydrazine,1,2-dibenzoyl-1,2-dimethyl- (7CI,8CI);NSC58886;1,2-Dibenzoyl-1,2-dimethylhydrazine; |
EINECS: | 214-961-0 |
Density: | 1.177 g/cm3 |
Melting Point: | 78-84 °C(lit.) |
Boiling Point: | 387.2 °C at 760 mmHg |
Flash Point: | 161.5 °C |
PSA: | 40.62000 |
LogP: | 2.44580 |
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The Benzoic acid,2-benzoyl-1,2-dimethylhydrazide, also known as 1,2-Dibenzoyl-1,2-dimethylhydrazine, is a organic compound with the formula C16H16N2O2. Its EINECS registry number is 214-961-0. With the CAS registry number 1226-43-3, its IUPAC name is called N'-benzoyl-N,N'-dimethylbenzohydrazide.
Physical properties of Benzoic acid,2-benzoyl-1,2-dimethylhydrazide: (1)ACD/LogP: 2.14; (2)ACD/LogD (pH 5.5): 2.14; (3)ACD/LogD (pH 7.4): 2.14; (4)ACD/BCF (pH 5.5): 24.82; (5)ACD/BCF (pH 7.4): 24.82; (6)ACD/KOC (pH 5.5): 346.72; (7)ACD/KOC (pH 7.4): 346.72; (8)#H bond acceptors: 4; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.599; (11)Molar Refractivity: 77.95 cm3; (12)Molar Volume: 227.8 cm3; (13)Surface Tension: 49.3 dyne/cm; (14)Density: 1.177 g/cm3; (15)Flash Point: 161.5 °C; (16)Enthalpy of Vaporization: 63.62 kJ/mol; (17)Boiling Point: 387.2 °C at 760 mmHg; (18)Vapour Pressure: 3.36E-06 mmHg at 25°C.
Preparation: this chemical can be prepared by 1,2-Dimethyl-3,5-diphenylpyrazolium-4-olat. This reaction will need reagents O2, Rose bengale and solvents toluene, methanol. The reaction time is 16 hours with reaction temperature of 5 °C. The yield is about 89%.
Uses of Benzoic acid,2-benzoyl-1,2-dimethylhydrazide: it can be used to produce 1,2-dimethyl-1,2-di(thiobenzoyl)hydrazine by heating. This reaction will need reagent Lawesson's reagent and solvent benzene. The yield is about 92%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN(C(=O)C1=CC=CC=C1)N(C)C(=O)C2=CC=CC=C2
(2)InChI: InChI=1S/C16H16N2O2/c1-17(15(19)13-9-5-3-6-10-13)18(2)16(20)14-11-7-4-8-12-14/h3-12H,1-2H3
(3)InChIKey: PQEZHJRKUSZEBK-UHFFFAOYSA-N