-
Name
1-(2,4-DIHYDROXY-6-METHOXY-PHENYL)-ETHANONE
- EINECS
- CAS No. 3602-54-8
- Article Data27
- CAS DataBase
- Density 1.284 g/cm3
- Solubility
- Melting Point 139-140 °C
- Formula C9H10O4
- Boiling Point 333.493 °C at 760 mmHg
- Molecular Weight 182.176
- Flash Point 135.517 °C
- Transport Information
- Appearance
- Safety
- Risk Codes
-
Molecular Structure
- Hazard Symbols
- Synonyms 1-(2,4-DIHYDROXY-6-METHOXY-PHENYL)-ETHANONE;2,4-Dihydroxy-6-methoxyacetophene;2,4-Dihydroxy-6-Methoxyacetophenone;2-O-Methylphloroacetophenone;6-O-Methylphloroacetophenone
- PSA 66.76000
- LogP 1.30900
1-(2,4-Dihydroxy-6-methoxyphenyl)ethanone Specification
Both the product and the systematic name of this chemical are the same which is called 1-(2,4-Dihydroxy-6-methoxyphenyl)ethanone. With the CAS registry number 3602-54-8, it is also known as Ethanone, 1-(2,4-dihydroxy-6-methoxyphenyl)-. This chemical's molecular formula is C9H10O4 and molecular weight is 182.1733.
Physical properties of 1-(2,4-Dihydroxy-6-methoxyphenyl)ethanone: (1)ACD/LogP: 2.32; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 27; (5)ACD/BCF (pH 7.4): 17; (6)ACD/KOC (pH 5.5): 367; (7)ACD/KOC (pH 7.4): 226; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 4; (11)Index of Refraction: 1.573; (12)Molar Refractivity: 46.723 cm3; (13)Molar Volume: 141.826 cm3; (14)Surface Tension: 51.077 dyne/cm; (15)Density: 1.284 g/cm3; (16)Flash Point: 135.517 °C; (17)Enthalpy of Vaporization: 59.922 kJ/mol; (18)Boiling Point: 333.493 °C at 760 mmHg; (19)Vapour Pressure: 0 mmHg at 25°C.
Preparation: this chemical can be prepared by 1-(2,4,6-trimethoxy-phenyl)-ethanone. This reaction will need reagent aluminium chloride.
ethanone.gif)
Uses of 1-(2,4-Dihydroxy-6-methoxyphenyl)ethanone: it can be used to produce 2,4-dihydroxy-3-iodo-6-methoxy-acetophenone at temperature of 60 - 70 °C. This reaction will need reagents iodine, periodic acid and solvent ethanol with reaction time of 2 hours. The yield is about 86%.
ethanone.gif)
You can still convert the following datas into molecular structure:
(1)SMILES: O=C(c1c(O)cc(O)cc1OC)C
(2)InChI: InChI=1/C9H10O4/c1-5(10)9-7(12)3-6(11)4-8(9)13-2/h3-4,11-12H,1-2H3
(3)InChIKey: IETZAWFZIAOWQX-UHFFFAOYAY
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