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3-Methyl-2-pyridone

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Name

3-Methyl-2-pyridone

EINECS 213-710-2
CAS No. 1003-56-1 Density 1.053 g/cm3
PSA 32.86000 LogP 0.68330
Solubility N/A Melting Point 139-141 °C
Formula C6H7NO Boiling Point 307.4 °C at 760 mmHg
Molecular Weight 109.128 Flash Point 172.7 °C
Transport Information N/A Appearance Light yellow needles
Safety 26-36 Risk Codes 22-37/38-41
Molecular Structure Molecular Structure of 1003-56-1 (3-Methyl-2-pyridone) Hazard Symbols IrritantXi
Synonyms

2(1H)-Pyridone,3-methyl- (6CI,7CI,8CI);2-Hydroxy-3-methylpyridine;3-Methyl-2(1H)-pyridinone;3-Methyl-2(1H)-pyridone;3-Methyl-2-pyridinol;3-Methyl-2-pyridinone;NSC 4343;2(1H)-pyridinone, 3-methyl-;2-pyridinol, 3-methyl-;3-Methylpyridin-2(1H)-one;3-methylpyridin-2-ol;

Article Data 32

3-Methyl-2-pyridone Specification

The 2(1H)-Pyridinone,3-methyl-, with the CAS registry number 1003-56-1 and EINECS registry number 213-710-2, has the systematic name of 3-methylpyridin-2(1H)-one. It is a kind of light yellow needles, and belongs to the following product categories: C6; Heterocyclic Building Blocks; Pyridines. And the molecular formula of this chemical is C6H7NO.

The physical properties of 2(1H)-Pyridinone,3-methyl- are as following: (1)ACD/LogP: 0.01; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.01; (4)ACD/LogD (pH 7.4): 0.01; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 24.13; (8)ACD/KOC (pH 7.4): 24.13; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 20.31 Å2; (13)Index of Refraction: 1.499; (14)Molar Refractivity: 30.44 cm3; (15)Molar Volume: 103.5 cm3; (16)Polarizability: 12.07×10-24cm3; (17)Surface Tension: 31.6 dyne/cm; (18)Density: 1.053 g/cm3; (19)Flash Point: 172.7 °C; (20)Enthalpy of Vaporization: 54.8 kJ/mol; (21)Boiling Point: 307.4 °C at 760 mmHg; (22)Vapour Pressure: 0.000724 mmHg at 25°C. 

Uses of 2(1H)-Pyridinone,3-methyl-: It can react with chloro-methoxy-methane to produce 1-methoxymethyl-3-methyl-1H-pyridin-2-one. This reaction will need reagent solvent CH2Cl2. The reaction time is 24 hours with ambient temperature, and the yield is about 51%.    

2(1H)-Pyridinone,3-methyl- can react with chloro-methoxy-methane to produce 1-methoxymethyl-3-methyl-1H-pyridin-2-one

You should be cautious while dealing with this chemical. It is harmful if swallowed, and it also irritates respiratory system and skin. What's more, it has risk of serious damage to eyes. Therefore, you had better take the following instructions: Wear suitable protective clothing, and in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C1/C(=C\C=C/N1)C
(2)InChI: InChI=1/C6H7NO/c1-5-3-2-4-7-6(5)8/h2-4H,1H3,(H,7,8)
(3)InChIKey: MVKDNXIKAWKCCS-UHFFFAOYAH

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