2,6-Diisopropylphenyl isocyanate → HCID 14555246, compound

HRID 359038Notes

Reaction equation

HRID 359038 reaction equation
[O:1]1[C:7]2[CH:8]=[CH:9][CH:10]=[CH:11][C:6]=2[CH2:5][CH:4]([NH2:12])[CH2:3][CH2:2]1.[CH3:13][CH:14]([C:16]1[CH:21]=[CH:20][CH:19]=[C:18]([CH:22]([CH3:24])[CH3:23])[C:17]=1[N:25]=[C:26]=[O:27])[CH3:15]>C(OCC)(=O)C>[CH3:15][CH:14]([C:16]1[CH:21]=[CH:20][CH:19]=[C:18]([CH:22]([CH3:23])[CH3:24])[C:17]=1[NH:25][C:26]([NH:12][CH:4]1[CH2:5][C:6]2[CH:11]=[CH:10][CH:9]=[CH:8][C:7]=2[O:1][CH2:2][CH2:3]1)=[O:27])[CH3:13]

Participants

4

Reactant 2

HCID 922592,6-Diisopropylphenyl isocyanateHCID 15124028126312-28-5

Product 1

HCID 14555246HCID 14555246, compoundYield 51.7%

Reagents, catalysts & solvents 1

HCID 8857Ethyl AcetateSolvent

Procedure

To a solution of 2,3,4,5-tetrahydro-benzoxepin-4-amine (0.95 g, 5.8 mmol) in 50 ml of ethyl acetate was added 1.18 g (5.8 mmol) of 2,6-bis(1-methylethyl)phenyl isocyanate. The resulting mixture was stirred at room temperature for 20 hours. The precipitated solid was collected by filtration, washed with ethyl acetate, and dried to yield 1.1 g of N-[2,6-bis(1-methylethyl)-phenyl]-N'-(2,3,4,5-tetrahydrobenzoxepin-4-yl)urea, mp 184-186° C.

Workup

  1. filtrationThe precipitated solid was collected by filtration
  2. washwashed with ethyl acetate
  3. customdried

Sources & evidence

ORD record
ord-ad5bc36de822475782088feec9f7d339
Source dataset
uspto-grants-1991_03
Patent number
US04999373

Reaction notes

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