Phosphorus oxychloride → 3,4-dihydro-2,2-dimethyl-4-(2-pyridyl)-2H-1-benzopyran-6-carbonitrile

반응식

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

참가 물질

반응물 2

HCID 24813Phosphorus oxychloride

HCID 198956333,4-dihydro-2,2-dimethyl-4-(2-pyridyl)-2H-1-benzopyran-6-carboxamide

생성물 1

HCID 150389003,4-dihydro-2,2-dimethyl-4-(2-pyridyl)-2H-1-benzopyran-6-carbonitrile

출처 및 근거

ORD 기록: ord-d6163b656c6d4feebd061fa8ad5b75cc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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