Benzoic acid, 2-isothiocyanato-, methyl ester → HCID 178515048, compound

HRID 574732Notes

Reaction equation

HRID 574732 reaction equation
[NH:1]1[C:5]2[CH:6]=[CH:7][C:8]([NH2:10])=[CH:9][C:4]=2[N:3]=[CH:2]1.[N:11]([C:14]1[CH:23]=[CH:22][CH:21]=[CH:20][C:15]=1[C:16](OC)=[O:17])=[C:12]=[S:13]>C1COCC1>[NH:1]1[C:5]2[CH:6]=[CH:7][C:8]([N:10]3[C:16](=[O:17])[C:15]4[C:14](=[CH:23][CH:22]=[CH:21][CH:20]=4)[NH:11][C:12]3=[S:13])=[CH:9][C:4]=2[N:3]=[CH:2]1

Participants

4

Reactant 2

HCID 85243Benzoic acid, 2-isothiocyanato-, methyl esterHCID 178507353HCID 178507353, compound

Product 1

HCID 178515048HCID 178515048, compound

Reagents, catalysts & solvents 1

HCID 8028TetrahydrofuranSolvent

Procedure

1H-benzo[d]imidazol-5-amine (0.14 g, 1.08 mmol) and methyl 2-isothiocyanatobenzoate (0.21 g, 1.08 mmol) were dissolved ind 10 mL of THF. The mixture was stirred by heating under reflux over night. The resulted insoluble solid was separated by suction through a frit and washed with THF to give a white solid.

Workup

  1. temperatureby heating
  2. temperatureunder reflux over night
  3. customThe resulted insoluble solid was separated by suction through a frit
  4. washwashed with THF
  5. customto give a white solid

Sources & evidence

ORD record
ord-b28db5be29f844f6933854bebe621c06
Source dataset
uspto-grants-2015_05
Patent number
US09034907B2

Reaction notes

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