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127978-70-5

127978-70-5 Structure

127978-70-5 Structure
IdentificationBack Directory
[Name]

(5-METHOXYPYRIDIN-2-YL)METHANOL
[CAS]

127978-70-5
[Synonyms]

3-Methoxy-6-pyridinemethanol
5-Methoxy-2-PyridineMethanol
(5-Methoxy-2-pyridyl)methanol
5-Methoxy pyridine-2-methanol
2-Pyridinemethanol, 5-methoxy-
(5-METHOXYPYRIDIN-2-YL)METHANOL
(5-Methoxypyridine-2-yl)methanol
5-methoxy-2-hydroxymethylpyridine
2-Pyridinemethanol,5-methoxy-(9CI)
2-(Hydroxymethyl)-5-methoxypyridine
(5-methoxypyridin-2-yl)methanol hydrochloride
[Molecular Formula]

C7H9NO2
[MDL Number]

MFCD08235020
[MOL File]

127978-70-5.mol
[Molecular Weight]

139.15
Chemical PropertiesBack Directory
[Boiling point ]

262℃
[density ]

1.155
[Fp ]

112℃
[storage temp. ]

Inert atmosphere,Room Temperature
[pka]

13.22±0.10(Predicted)
[Appearance]

White to light yellow Solid
[InChI]

InChI=1S/C7H9NO2/c1-10-7-3-2-6(5-9)8-4-7/h2-4,9H,5H2,1H3
[InChIKey]

YSGIZFIQWAPBLG-UHFFFAOYSA-N
[SMILES]

C1(CO)=NC=C(OC)C=C1
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[HS Code ]

2933399990
Hazard InformationBack Directory
[Uses]

(5-Methoxypyridin-2-yl)methanol is used in preparation of substituted pyrrolopyridinones as HPK1 antagonists and uses thereof.
[Synthesis]

2-Pyridinemethanol, 5-methoxy-, 2-acetate

75342-32-4

(5-METHOXYPYRIDIN-2-YL)METHANOL

127978-70-5

Compound 12 (CAS: 75342-32-4, 1.40 g, 7.7 mmol) was used as raw material, which was dissolved in methanol (30 mL) and excess potassium hydroxide was added. The reaction mixture was heated to reflux for 2 hours. After completion of the reaction, the solvent was removed by rotary evaporator under reduced pressure. The residue was extracted by partitioning with dichloromethane (20 mL) and water (20 mL). The organic phase was separated, dried with anhydrous sodium sulfate, filtered and concentrated under reduced pressure to give compound 13 (5-methoxypyridine-2-methanol) as a light yellow oil (1.00 g, 93% yield). The product was characterized by 1H NMR (CDCl3): δ 1.82 (s, 1H), 3.87 (s, 3H), 4.70 (s, 2H), 7.18-7.24 (m, 2H), 8.25 (d, 1H, J = 2.8 Hz); GC/MS analysis showed m/z 140 (M++1, 3%), 139 (M+, 44%), 138 ( 100%), 110 (71%).

[References]

[1] Bioorganic and Medicinal Chemistry, 2015, vol. 23, # 14, p. 3913 - 3924
[2] Patent: US6194437, 2001, B1
[3] Patent: US2006/14945, 2006, A1. Location in patent: Page/Page column 40
[4] Journal of Medicinal Chemistry, 1992, vol. 35, # 3, p. 438 - 450
[5] Patent: WO2007/120729, 2007, A2. Location in patent: Page/Page column 40
Spectrum DetailBack Directory
[Spectrum Detail]

(5-METHOXYPYRIDIN-2-YL)METHANOL(127978-70-5)1HNMR
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