Phenyl isocyanate → 4-Phenylcarbamoyl-2,2,7,7-tetramethyl-1,4-diazacycloheptan-5-one

HRID 1205260

반응식

HRID 1205260 반응식
[CH3:1][C:2]1([CH3:12])[NH:3][C:4]([CH3:10])([CH3:11])[CH2:5][C:6](=[O:9])[NH:7][CH2:8]1.[c:13]1([N:19]=[C:20]=[O:21])[cH:14][cH:15][cH:16][cH:17][cH:18]1>>[CH3:1][C:2]1([CH3:12])[NH:3][C:4]([CH3:10])([CH3:11])[CH2:5][C:6](=[O:9])[N:7]([C:20]([NH:19][c:13]2[cH:14][cH:15][cH:16][cH:17][cH:18]2)=[O:21])[CH2:8]1

참가 물질

3

반응물 2

HCID 7672Phenyl isocyanateHCID 5469102,2,7,7-Tetramethyl-1,4-diazepan-5-one

생성물 1

HCID 215303084-Phenylcarbamoyl-2,2,7,7-tetramethyl-1,4-diazacycloheptan-5-one

출처 및 근거

ORD 기록
ord-937d7b78ae634c77853532849dd5a5b9
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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