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| CAS No.: | 16208-17-6 |
|---|---|
| Name: | 4-METHOXYPHENYLGLYOXAL HYDRATE |
| Article Data: | 41 |
| Molecular Structure: | |
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|
|
| Formula: | C9H10O4 |
| Molecular Weight: | 182.176 |
| Synonyms: | Acetophenone,2,2-dihydroxy-4'-methoxy- (8CI);NSC 152033; |
| EINECS: | -0 |
| Density: | 1.297 g/cm3 |
| Melting Point: | 126-128 °C |
| Boiling Point: | 335 °C at 760 mmHg |
| Flash Point: | 136.2 °C |
| Hazard Symbols: |
 Xi
|
| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37/39 |
| PSA: | 52.60000 |
| LogP: | 1.01250 |
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Specification
The Ethanone,2,2-dihydroxy-1-(4-methoxyphenyl)- is an organic compound with the formula C9H10O4. The IUPAC name of this chemical is 2,2-Dihydroxy-1-(4-methoxyphenyl)ethanone. The CAS registry number of this chemical is 16208-17-6. Besides, its molecular weight is 182.1733.
Physical properties about Ethanone,2,2-dihydroxy-1-(4-methoxyphenyl)- are: (1)ACD/LogP: -0.10; (2)#H bond acceptors: 4; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 5; (5)Polar Surface Area: 44.76 Å2; (6)Index of Refraction: 1.569; (7)Molar Refractivity: 45.98 cm3; (8)Molar Volume: 140.3 cm3; (9)Polarizability: 18.23×10-24 cm3; (10)Surface Tension: 53.7 dyne/cm; (11)Density: 1.297 g/cm3; (12)Flash Point: 136.2 °C; (13)Enthalpy of Vaporization: 61.01 kJ/mol; (14)Boiling Point: 335 °C at 760 mmHg; (15)Vapour Pressure: 4.85E-05 mmHg at 25 °C.
Preparation: this chemical can be prepared by (4-Methoxy-phenyl)-oxo-acetaldehyde. This reaction will need reagent H2O. The reaction time is 3 hours. The yield is about 72%.
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Uses of Ethanone,2,2-dihydroxy-1-(4-methoxyphenyl)-: it can be used to produce (4-Methoxy-phenyl)-oxo-acetaldehyde oxime at temperature of 50 °C. It will need reagents acetonoxime; 2 N HCl and solvent H2O with reaction time of 2 hours. The yield is about 92%.
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You can still convert the following datas into molecular structure:
(1)InChI: InChI=1/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,9,11-12H,1H3
(2)InChIKey: NLUFPYPVEHQAQN-UHFFFAOYAD
(3)Std. InChI: InChI=1S/C9H10O4/c1-13-7-4-2-6(3-5-7)8(10)9(11)12/h2-5,9,11-12H,1H3
(4)Std. InChIKey: NLUFPYPVEHQAQN-UHFFFAOYSA-N