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Basic Information
CAS No.: 1124-29-4
Name: 2(1H)-Pyridinone, 5-acetyl- (9CI)
Article Data: 7
Molecular Structure:
Molecular Structure of 1124-29-4 (2(1H)-Pyridinone, 5-acetyl- (9CI))
Formula: C7H7NO2
Molecular Weight: 137.138
Synonyms: 2(1H)-Pyridone,5-acetyl- (7CI,8CI);1-(2-Hydroxypyridin-5-yl)ethanone;5-Acetyl-2-pyridone;
Density: 1.217 g/cm3
Boiling Point: 364.7 °C at 760 mmHg
Flash Point: 174.4 °C
PSA: 50.19000
LogP: 0.98980
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Specification

The 2(1H)-Pyridinone,5-acetyl-, with the CAS registry number 1124-29-4, is also known as 5-Acetyl-2(1H)-pyridinone. It belongs to the product category of Acetylgroup. This chemical's molecular formula is C7H7NO2 and molecular weight is 137.13598. Its IUPAC name is called 5-acetyl-1H-pyridin-2-one.

Physical properties of 2(1H)-Pyridinone,5-acetyl-: (1)ACD/BCF (pH 5.5): 1; (2)ACD/BCF (pH 7.4): 1; (3)ACD/KOC (pH 5.5): 1.61; (4)ACD/KOC (pH 7.4): 1.44; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 1; (8)Index of Refraction: 1.557; (9)Molar Refractivity: 36.25 cm3; (10)Molar Volume: 112.6 cm3; (11)Surface Tension: 51.4 dyne/cm; (12)Density: 1.217 g/cm3; (13)Flash Point: 174.4 °C; (14)Enthalpy of Vaporization: 63.49 kJ/mol; (15)Boiling Point: 364.7 °C at 760 mmHg; (16)Vapour Pressure: 7.87E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC(=O)C1=CNC(=O)C=C1
(2)InChI: InChI=1S/C7H7NO2/c1-5(9)6-2-3-7(10)8-4-6/h2-4H,1H3,(H,8,10)
(3)InChIKey: OMNAPXPEWSOPER-UHFFFAOYSA-N