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3-Amino-5-methyl-2-pyridone

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Name

3-Amino-5-methyl-2-pyridone

EINECS N/A
CAS No. 52334-51-7 Density 1.137g/cm3
PSA 59.14000 LogP 1.25900
Solubility N/A Melting Point 119-120ºC
Formula C6H8N2O Boiling Point 337.1 °C at 760 mmHg
Molecular Weight 124.142 Flash Point 157.6 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 52334-51-7 (2-HYDROXY-3-AMINO-5-PICOLINE) Hazard Symbols N/A
Synonyms

3-Amino-5-methyl-2-pyridone;

 

3-Amino-5-methyl-2-pyridone Specification

The 2(1H)-Pyridinone,3-amino-5-methyl-, with CAS registry number 52334-51-7, belongs to the following product category: Pyridine. It has the systematic name of 3-amino-5-methylpyridin-2(1H)-one. And the chemical formula of this chemical is C6H8N2O.

Physical properties of 2(1H)-Pyridinone,3-amino-5-methyl-: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 10.35; (5)ACD/KOC (pH 7.4): 10.44; (6)#H bond acceptors: 3; (7)#H bond donors: 3; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 55.12 Å2; (10)Index of Refraction: 1.535; (11)Molar Refractivity: 33.99 cm3; (12)Molar Volume: 109.1 cm3; (13)Polarizability: 13.47×10-24cm3; (14)Surface Tension: 38.3 dyne/cm; (15)Density: 1.137 g/cm3; (16)Flash Point: 157.6 °C; (17)Enthalpy of Vaporization: 58.03 kJ/mol; (18)Boiling Point: 337.1 °C at 760 mmHg; (19)Vapour Pressure: 0.000108 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: C\C\1=C\NC(=O)C(/N)=C/1
(2)InChI: InChI=1/C6H8N2O/c1-4-2-5(7)6(9)8-3-4/h2-3H,7H2,1H3,(H,8,9)
(3)InChIKey: LLMWKBGTHYWHGU-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C6H8N2O/c1-4-2-5(7)6(9)8-3-4/h2-3H,7H2,1H3,(H,8,9)
(5)Std. InChIKey: LLMWKBGTHYWHGU-UHFFFAOYSA-N

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