Toluene → 7-Chloro-2-(2-chloroethyl)-2,3-dihydro-4-methyl-1,4-benzoxazepine-5(4H)-thione

HRID 1113865

반응식

HRID 1113865 반응식
[CH3:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1.[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[C:7](=[O:16])[N:8]([CH3:15])[CH2:9][CH:10]([CH2:12][CH2:13][Cl:14])[O:11]2.[P:18]12(=[S:19])[S:20][P:21]3(=[S:31])[S:22][P:23](=[S:29])([S:24][P:25](=[S:28])([S:26]3)[S:27]1)[S:30]2>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([cH:17]1)[C:7](=[S:19])[N:8]([CH3:15])[CH2:9][CH:10]([CH2:12][CH2:13][Cl:14])[O:11]2

참가 물질

4

반응물 3

HCID 1140TolueneHCID 14817Phosphorus sulfide (P2S5)HCID 137262967-chloro-2-(2-chloroethyl)-2,3-dihydro-4-methyl-1,4-benzoxazepin-5(4H)one

생성물 1

HCID 137263017-Chloro-2-(2-chloroethyl)-2,3-dihydro-4-methyl-1,4-benzoxazepine-5(4H)-thione

출처 및 근거

ORD 기록
ord-6ae1faba784640e0bd446964dd2c831c
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

연결된 노트

불러오는 중…