Acetic Acid → HCID 18545645, compound

HRID 291782Notes

Reaction equation

HRID 291782 reaction equation
[CH2:1]([O:2][C:3](=[O:4])[N:7]1[CH2:8][CH2:9][N:10]([c:13]2[n:14][cH:15][c:16](-[c:19]3[n:20][c:21]([NH:25][c:26]4[cH:27][c:28]([Cl:34])[c:29]([Cl:33])[c:30]([Cl:32])[cH:31]4)[n:22][cH:23][cH:24]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1)[CH:5]=[CH2:6].[CH2:39]([SnH:40]([CH2:41][CH2:42][CH2:43][CH3:44])[CH2:45][CH2:46][CH2:47][CH3:48])[CH2:49][CH2:50][CH3:51].[CH3:35][C:36](=[O:37])[OH:38].[Cl:57][CH2:58][Cl:59].[Na+:56].[O-:52][C:53]([OH:54])=[O:55].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64]>>[NH:7]1[CH2:8][CH2:9][N:10]([c:13]2[n:14][cH:15][c:16](-[c:19]3[n:20][c:21]([NH:25][c:26]4[cH:27][c:28]([Cl:34])[c:29]([Cl:33])[c:30]([Cl:32])[cH:31]4)[n:22][cH:23][cH:24]3)[cH:17][cH:18]2)[CH2:11][CH2:12]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 5948TributylstannaneHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 18545608HCID 18545608, compound

Product 1

HCID 18545645HCID 18545645, compound

Sources & evidence

ORD record
ord-0e6331291bf541efa74029cfb5d525cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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