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Hydrazine hydrate (1:1) → 4-(4-Amino-pyridin-2-ylmethyl)-2H-phthalazin-1-one

HRID 600266
Notes
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Reaction equation

HRID 600266 reaction equation
[N+:1]([C:4]1[CH:9]=[CH:8][N:7]=[C:6]([CH:10]=[C:11]2[C:19]3[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=3)[C:13](=O)[O:12]2)[CH:5]=1)([O-])=O.O.[NH2:22][NH2:23].[Cl-].[NH4+]>[Fe].C(O)C>[NH2:1][C:4]1[CH:9]=[CH:8][N:7]=[C:6]([CH2:10][C:11]2[C:19]3[C:14](=[CH:15][CH:16]=[CH:17][CH:18]=3)[C:13](=[O:12])[NH:23][N:22]=2)[CH:5]=1
ParticipantsConditionsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 24654Hydrazine hydrate (1:1)HCID 25517Ammonium ChlorideHCID 689120253-(4-Nitro-pyridin-2-ylmethylene)-3H-isobenzofuran-1-one

Product 1

HCID 598565694-(4-Amino-pyridin-2-ylmethyl)-2H-phthalazin-1-oneYield 31%

Reagents, catalysts & solvents 2

HCID 23925IronCatalyst
HCID 702
Ethanol
Solvent

Conditions

Temperature
90 °C

Procedure

A suspension of 3-(4-nitro-pyridin-2-ylmethylene)-3H-isobenzofuran-1-one (0.67 g, 2.5 mmol) in hydrazine monohydrate (0.25 g, 5.0 mmol) was heated to 90° C. for 1 hour and then cooled to room temperature. Ethanol (5 mL) added, followed by ammonium chloride (0.16 g, 3.0 mmol) and iron powder (0.28 g, 5.0 mmol), the mixture was then heated to 90° C. for 3 hours. The reaction mixture was filtered hot through celite which was washed with ethyl acetate (20 mL). The filtered was concentrated in vacuo and then diluted with ethyl acetate (10 mL) washed with brine (10 mL), dried over magnesium, sulphate and dried in vacuo to afford the title cpd as a pale yellow powder. Single peak in LC-MS analysis, (0.20 g, 31% yield) requiring no further purification, m/z (LC-MS, ESP), RT=1.58 (M+H) 253;

Workup

  1. temperaturecooled to room temperature
  2. temperaturethe mixture was then heated to 90° C. for 3 hours
  3. filtrationThe reaction mixture was filtered hot through celite which
  4. washwas washed with ethyl acetate (20 mL)
  5. concentrationThe filtered was concentrated in vacuo
  6. additiondiluted with ethyl acetate (10 mL)
  7. washwashed with brine (10 mL)
  8. dry with materialdried over magnesium, sulphate
  9. customdried in vacuo
  10. customto afford the title cpd as a pale yellow powder
  11. customno further purification, m/z (LC-MS, ESP), RT=1.58 (M+H) 253

Sources & evidence

ORD record
ord-f5fc8a10342649b9bdecf4db908d0f34
Source dataset
uspto-grants-2011_03
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US07902193B2

Reaction notes

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