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| CAS No.: | 63071-09-0 |
|---|---|
| Name: | 2-HYDROXYMETHYL-3-METHYLPYRIDINE |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C7H9NO |
| Molecular Weight: | 123.155 |
| Synonyms: | (3-Methyl-2-pyridinyl)methanol;2-(Hydroxymethyl)-3-methylpyridine;3-Methylpyridine-2-methanol; |
| Density: | 1.092 g/cm3 |
| Melting Point: | 102 °C |
| Boiling Point: | 236.8 °C at 760 mmHg |
| Flash Point: | 97 °C |
| PSA: | 33.12000 |
| LogP: | 0.88230 |
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- Total:18 Page 1 of 1 1
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Specification
The 2-Pyridinemethanol,3-methyl-, with the CAS registry number 63071-09-0, is also known as 2-Hydroxymethyl-3-methylpyridine. It belongs to the product category of Pharmacetical. This chemical's molecular formula is C7H9NO and molecular weight is 123.068414. Its IUPAC name is called (3-methylpyridin-2-yl)methanol.
Physical properties of 2-Pyridinemethanol,3-methyl-: (1)ACD/LogD (pH 5.5): -0.15; (2)ACD/LogD (pH 7.4): 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 16.65; (6)ACD/KOC (pH 7.4): 23.77; (7)#H bond acceptors: 2; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 2; (10)Index of Refraction: 1.544; (11)Molar Refractivity: 35.62 cm3; (12)Molar Volume: 112.7 cm3; (13)Surface Tension: 45.3 dyne/cm; (14)Density: 1.092 g/cm3; (15)Flash Point: 97 °C; (16)Enthalpy of Vaporization: 50.05 kJ/mol; (17)Boiling Point: 236.8 °C at 760 mmHg; (18)Vapour Pressure: 0.0255 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(N=CC=C1)CO
(2)InChI: InChI=1S/C7H9NO/c1-6-3-2-4-8-7(6)5-9/h2-4,9H,5H2,1H3
(3)InChIKey: ACDAPUOXXWLLSC-UHFFFAOYSA-N