Product Name

  • Name

    2-Pyridinemethanol,3,6-dimethyl-

  • EINECS
  • CAS No. 848774-90-3
  • Article Data1
  • CAS DataBase
  • Density 1.063 g/cm3
  • Solubility
  • Melting Point
  • Formula C8H11NO
  • Boiling Point 239.4 °C at 760 mmHg
  • Molecular Weight 137.181
  • Flash Point 98.6 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 848774-90-3 (2-Pyridinemethanol,3,6-dimethyl-)
  • Hazard Symbols
  • Synonyms (3,6-Dimethylpyridin-2-yl)methanol; 2-pyridinemethanol, 3,6-dimethyl-; LogP
  • PSA 33.12000
  • LogP 1.19070

Synthetic route

3,6-dimethyl-2-pyridinecarbonitrile
68164-77-2

3,6-dimethyl-2-pyridinecarbonitrile

(3,6-dimethylpyridin-2-yl)methanol
848774-90-3

(3,6-dimethylpyridin-2-yl)methanol

Conditions
ConditionsYield
With hydrogenchloride; hydrogen; palladium on activated charcoal under 1551.44 Torr; for 2h;57%
2,5-dimethylpyridine N-oxide
4986-05-4

2,5-dimethylpyridine N-oxide

(3,6-dimethylpyridin-2-yl)methanol
848774-90-3

(3,6-dimethylpyridin-2-yl)methanol

Conditions
ConditionsYield
Multi-step reaction with 3 steps
1: CH2Cl2 / 0.42 h / 20 °C
2: 9.72 g / Et2NCOCl / CH2Cl2 / 96 h / 20 °C
3: 57 percent / H2; aq. HCl / Pd/C / 2 h / 1551.44 Torr
View Scheme
2-cyano-3,6-dimethylpyridine 1-oxide
892665-90-6

2-cyano-3,6-dimethylpyridine 1-oxide

(3,6-dimethylpyridin-2-yl)methanol
848774-90-3

(3,6-dimethylpyridin-2-yl)methanol

Conditions
ConditionsYield
Multi-step reaction with 2 steps
1: 9.72 g / Et2NCOCl / CH2Cl2 / 96 h / 20 °C
2: 57 percent / H2; aq. HCl / Pd/C / 2 h / 1551.44 Torr
View Scheme
6-chloro-3-phenyl-7,8,9,10-tetrahydro-(7,10-ethano)-1,2,4-triazolo[3,4-a]phthalazine
202931-56-4

6-chloro-3-phenyl-7,8,9,10-tetrahydro-(7,10-ethano)-1,2,4-triazolo[3,4-a]phthalazine

(3,6-dimethylpyridin-2-yl)methanol
848774-90-3

(3,6-dimethylpyridin-2-yl)methanol

C25H25N5O

C25H25N5O

Conditions
ConditionsYield
Stage #1: (3,6-dimethylpyridin-2-yl)methanol With sodium hydride In N,N-dimethyl-formamide at 20℃;
Stage #2: 6-chloro-3-phenyl-7,8,9,10-tetrahydro-(7,10-ethano)-1,2,4-triazolo[3,4-a]phthalazine In N,N-dimethyl-formamide at 20℃;		54%

2-Pyridinemethanol,3,6-dimethyl- Specification

The 2-Pyridinemethanol,3,6-dimethyl- is an organic compound with the formula C8H11NO. The systematic name of this chemical is (3,6-Dimethyl-2-pyridyl)methanol. The CAS registry number of this chemical is 848774-90-3. Besides, its molecular weight is 137.179.

The physical properties of 2-Pyridinemethanol,3,6-dimethyl- are: (1)ACD/LogP: 0.46; (2)ACD/LogD (pH 7.4): 0.45; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 33.12 Å2; (7)Index of Refraction: 1.539; (8)Molar Refractivity: 40.44 cm3; (9)Molar Volume: 129 cm3; (10)Polarizability: 16.03×10-24 cm3; (11)Surface Tension: 42.9 dyne/cm; (12)Density: 1.063 g/cm3; (13)Flash Point: 98.6 °C; (14)Enthalpy of Vaporization: 50.33 kJ/mol; (15)Boiling Point: 239.4 °C at 760 mmHg; (16)Vapour Pressure: 0.0219 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: Cc1ccc(nc1CO)C
(2)InChI: InChI=1/C8H11NO/c1-6-3-4-7(2)9-8(6)5-10/h3-4,10H,5H2,1-2H3
(3)InChIKey: YOTZYRMTQVHWGT-UHFFFAOYAU
(4)Std. InChI: InChI=1S/C8H11NO/c1-6-3-4-7(2)9-8(6)5-10/h3-4,10H,5H2,1-2H3
(5)Std. InChIKey: YOTZYRMTQVHWGT-UHFFFAOYSA-N

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