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Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)-

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Name

Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)-

EINECS N/A
CAS No. 66108-30-3 Density 1.323 g/cm3
PSA 83.12000 LogP 2.33460
Solubility N/A Melting Point 133-136 °C(lit.)
Formula C9H9NO4 Boiling Point 254 °C at 760 mmHg
Molecular Weight 195.175 Flash Point 106 °C
Transport Information N/A Appearance N/A
Safety 26-36 Risk Codes 36/37/38
Molecular Structure Molecular Structure of 66108-30-3 (2'-HYDROXY-5'-METHYL-3'-NITROACETOPHENONE) Hazard Symbols IrritantXi
Synonyms

Acetophenone,2'-hydroxy-5'-methyl-3'-nitro- (6CI,7CI);2-Acetyl-4-methyl-6-nitrophenol;2-Hydroxy-5-methyl-3-nitroacetophenone;

Article Data 8

Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)- Specification

The Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)-, with the CAS registry number 66108-30-3, is also known as 2'-Hydroxy-5'-methyl-3'-nitroacetophenone. It belongs to the product categories of Aromatic Acetophenones & Derivatives (substituted); C9; Carbonyl Compounds; Ketones. This chemical's molecular formula is C9H9NO4 and molecular weight is 195.17. Its systematic name is called 1-(2-hydroxy-5-methyl-3-nitrophenyl)ethanone.

Physical properties of Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)-: (1)ACD/LogP: 2.75; (2)#H bond acceptors: 5; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 3; (5)Index of Refraction: 1.586; (6)Molar Refractivity: 49.53 cm3; (7)Molar Volume: 147.5 cm3; (8)Surface Tension: 54.3 dyne/cm; (9)Density: 1.323 g/cm3; (10)Flash Point: 106 °C; (11)Enthalpy of Vaporization: 51.13 kJ/mol; (12)Boiling Point: 254 °C at 760 mmHg; (13)Vapour Pressure: 0.0111 mmHg at 25°C.

Uses of Ethanone,1-(2-hydroxy-5-methyl-3-nitrophenyl)-: it can be used to produce 2-hydroxy-3-nitro-5-methyl-acetophenone anil by heating. This reaction will need solvent benzene with reaction time of 6 hours. The yield is about 70%.

When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)SMILES: O=[N+]([O-])c1cc(cc(C(=O)C)c1O)C
(2)InChI: InChI=1/C9H9NO4/c1-5-3-7(6(2)11)9(12)8(4-5)10(13)14/h3-4,12H,1-2H3
(3)InChIKey: XSHQMMIEZHWNAK-UHFFFAOYAS

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