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CAS No.: | 66497-42-5 |
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Name: | 3-Hydroxy-6-methylpyridine-2-carboxaldehyde |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C7H7NO2 |
Molecular Weight: | 137.136 |
Synonyms: | 2-Formyl-3-hydroxy-6-methylpyridine;3-Hydroxy-6-methyl-2-pyridinecarboxaldehyde; |
Density: | 1.258 g/cm3 |
Melting Point: | 106-107 °C |
Boiling Point: | 283.596 °C at 760 mmHg |
Flash Point: | 125.315 °C |
PSA: | 50.19000 |
LogP: | 0.90810 |
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The 2-Pyridinecarboxaldehyde,3-hydroxy-6-methyl- is an organic compound with the formula C7H7NO2. The systematic name of this chemical is 3-Hydroxy-6-methylpyridine-2-carbaldehyde. With the CAS registry number 66497-42-5, it is also named as 3-Hydroxy-6-methylpyridine-2-carbaldehyde. Besides, its molecular weight is 137.136.
The physical properties of 2-Pyridinecarboxaldehyde,3-hydroxy-6-methyl- are: (1)ACD/LogP: 0.79; (2)ACD/LogD (pH 5.5): 1; (3)ACD/LogD (pH 7.4): 1; (4)ACD/BCF (pH 5.5): 2; (5)ACD/BCF (pH 7.4): 1; (6)ACD/KOC (pH 5.5): 33; (7)ACD/KOC (pH 7.4): 20; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 50.19 Å2; (12)Index of Refraction: 1.61; (13)Molar Refractivity: 37.804 cm3; (14)Molar Volume: 109.028 cm3; (15)Polarizability: 14.986×10-24 cm3; (16)Surface Tension: 56.666 dyne/cm; (17)Density: 1.258 g/cm3; (18)Flash Point: 125.315 °C; (19)Enthalpy of Vaporization: 54.351 kJ/mol; (20)Boiling Point: 283.596 °C at 760 mmHg; (21)Vapour Pressure: 0.002 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: Oc1ccc(C)nc1C=O
(2)InChI: InChI=1/C7H7NO2/c1-5-2-3-7(10)6(4-9)8-5/h2-4,10H,1H3
(3)InChIKey: RDQQJPSVWVFAJK-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C7H7NO2/c1-5-2-3-7(10)6(4-9)8-5/h2-4,10H,1H3
(5)Std. InChIKey: RDQQJPSVWVFAJK-UHFFFAOYSA-N