3-(Hydroxymethyl)phenyl acetate → HCID 86725537, compound

HRID 878569Notes

Reaction equation

HRID 878569 reaction equation
[OH:1][C:2]1[N:6]([C:7]2[CH:12]=[C:11]([C:13]#[N:14])[CH:10]=[CH:9][N:8]=2)[N:5]=[CH:4][CH:3]=1.[C:15]([O:18][C:19]1[CH:24]=[CH:23][CH:22]=[C:21]([CH2:25]O)[CH:20]=1)(=[O:17])[CH3:16]>>[C:15]([O:18][C:19]1[CH:24]=[CH:23][CH:22]=[C:21]([CH2:25][O:1][C:2]2[N:6]([C:7]3[CH:12]=[C:11]([C:13]#[N:14])[CH:10]=[CH:9][N:8]=3)[N:5]=[CH:4][CH:3]=2)[CH:20]=1)(=[O:17])[CH3:16]

Participants

3

Reactant 2

HCID 139456123-(Hydroxymethyl)phenyl acetateHCID 178510213HCID 178510213, compound

Product 1

HCID 86725537HCID 86725537, compound

Procedure

The title compound was prepared from 2-(5-hydroxy-1H-pyrazol-1-yl)pyridine-4-carbonitrile and 3-(hydroxymethyl)phenyl acetate according to the procedure for the preparation of Example 39, part C. 1H NMR (400 MHz, CDCl3): δ 2.24 (3H, s), 5.17 (2H, s), 5.66 (1H, d, J=1.6 Hz), 7.01-7.03 (1H, m), 7.14 (1H, s), 7.20-7.22 (1H, m), 7.32-7.36 (2H, m), 7.49 (1H, d, J=1.6 Hz), 7.97 (1H, s), 8.63 (1H, d, J=4.8 Hz). [M+H] Calc'd for C18H14N4O3, 335; Found, 335.

Sources & evidence

ORD record
ord-89834f7a49804361bcd04007dfa5ef69
Source dataset
uspto-grants-2015_03
Patent number
US08987461B2

Reaction notes

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