Phosgene → Methyl 4-ethoxy-2-(isocyanatosulfonyl)benzoate

반응식

[CH3:18][CH2:19][CH2:20][CH2:21][N:22]=[C:23]=[O:24].[Cl:25][C:26](=[O:27])[Cl:28].[NH2:1][S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13]([O:15][CH2:16][CH3:17])[cH:14]1>>[N:1]([S:2](=[O:3])(=[O:4])[c:5]1[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11][cH:12][c:13]([O:15][CH2:16][CH3:17])[cH:14]1)=[C:23]=[O:24]

참가 물질

반응물 3

HCID 6371Phosgene

HCID 8110Butyl isocyanate

HCID 13987872Methyl 2-(aminosulfonyl)-4-ethoxybenzoate

생성물 1

HCID 13987873Methyl 4-ethoxy-2-(isocyanatosulfonyl)benzoate

출처 및 근거

ORD 기록: ord-68d46ef0177846d3ba5b03a1de253dd7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

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