Chloride → HCID 178521865, compound

HRID 2327872Notes

Reaction equation

HRID 2327872 reaction equation
[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[Cl-:45].[Cl-:46].[Cl:32][C:33](=[O:34])[O:35][c:36]1[cH:37][cH:38][c:39]([N+:40]([O-:41])=[O:42])[cH:43][cH:44]1.[Cl:68][CH2:69][Cl:70].[F:8][c:9]1[c:10]([CH:16]2[CH2:17][CH2:18][CH:19]([NH2:31])[c:20]3[n:21]([c:23]([CH:26]4[CH2:27][O:28][CH2:29][CH2:30]4)[cH:24][n:25]3)[CH2:22]2)[cH:11][cH:12][cH:13][c:14]1[F:15].[O:47]=[c:48]1[n:49]([CH:57]2[CH2:58][CH2:59][NH2+:60][CH2:61][CH2:62]2)[c:50]2[c:51]([nH+:52][cH:53][cH:54][cH:55]2)[nH:56]1.[O:63]1[CH2:64][CH2:65][CH2:66][CH2:67]1>>[F:8][c:9]1[c:10]([CH:16]2[CH2:17][CH2:18][CH:19]([NH:31][C:33](=[O:34])[N:60]3[CH2:59][CH2:58][CH:57]([n:49]4[c:48](=[O:47])[nH:56][c:51]5[c:50]4[cH:55][cH:54][cH:53][n:52]5)[CH2:62][CH2:61]3)[c:20]3[n:21]([c:23]([CH:26]4[CH2:27][O:28][CH2:29][CH2:30]4)[cH:24][n:25]3)[CH2:22]2)[cH:11][cH:12][cH:13][c:14]1[F:15]

Participants

8

Reactant 7

HCID 312Chloride2×HCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 821294-Nitrophenyl chloroformateHCID 178507397HCID 178507397, compoundHCID 178518667HCID 178518667, compound

Product 1

HCID 178521865HCID 178521865, compound

Sources & evidence

ORD record
ord-adb0bb8f370f46d39e1e468bab1875d4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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