Hexyl isocyanate → HCID 86628147, compound

HRID 1685225Notes

Reaction equation

HRID 1685225 reaction equation
[Cl:1][C:2]1[N:7]=[C:6]2[NH:8][N:9]=[C:10]([OH:11])[C:5]2=[C:4]([CH3:12])[CH:3]=1.[N:13]([CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH3:21])=[C:14]=[O:15]>C1COCC1>[CH2:16]([NH:13][C:14]([N:9]1[C:10](=[O:11])[C:5]2[C:6](=[N:7][C:2]([Cl:1])=[CH:3][C:4]=2[CH3:12])[NH:8]1)=[O:15])[CH2:17][CH2:18][CH2:19][CH2:20][CH3:21]

Participants

4

Reactant 2

HCID 75659Hexyl isocyanateHCID 178426134HCID 178426134, compound

Product 1

HCID 86628147HCID 86628147, compound

Reagents, catalysts & solvents 1

HCID 8028TetrahydrofuranSolvent

Procedure

In analogy to example 1c, 500 mg (2.72 mmol) of 6-chloro-4-methyl-1H-pyrazolo-[3,4-b]pyridin-3-ol were reacted with 346.3 mg (2.72 mmol) of 1-isocyanatohexane in THF at 60° C. Yield: 428 mg (51%), M+H+: 311.27.

Sources & evidence

ORD record
ord-47f43222f371497998da0b13181a7f7a
Source dataset
uspto-grants-2012_04
Patent number
US08148395B2

Reaction notes

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