Acetate → HCID 86671051, compound

HRID 2334486Notes

Reaction equation

HRID 2334486 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([C:8]2([NH:12][S:13](=[O:14])[C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:9][CH2:10][CH2:11]2)[n:6][cH:7]1.[CH3:23][C:24](=[O:25])[O-:26].[CH3:63][O:64][CH2:65][CH2:66][O:67][CH3:68].[Cl:19][CH2:20][Cl:21].[I:27][c:28]1[c:29](=[O:56])[c:30]2[cH:31][cH:32][n:33]3[c:34]([c:35]2[o:36][c:37]1-[c:38]1[cH:39][cH:40][cH:41][cH:42][cH:43]1)[n:44][n:45]([CH2:48][O:49][CH2:50][CH2:51][Si:52]([CH3:53])([CH3:54])[CH3:55])[c:46]3=[O:47].[K+:22].[Na+:57].[Na+:58].[O-:59][C:60](=[O:61])[O-:62]>>[c:2]1(-[c:28]2[c:29](=[O:56])[c:30]3[cH:31][cH:32][n:33]4[c:34]([c:35]3[o:36][c:37]2-[c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[n:44][n:45]([CH2:48][O:49][CH2:50][CH2:51][Si:52]([CH3:53])([CH3:54])[CH3:55])[c:46]4=[O:47])[cH:3][cH:4][c:5]([C:8]2([NH:12][S:13](=[O:14])[C:15]([CH3:16])([CH3:17])[CH3:18])[CH2:9][CH2:10][CH2:11]2)[n:6][cH:7]1

Participants

9

Reactant 8

HCID 175AcetateHCID 813Potassium CationHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 67067901HCID 67067901, compoundHCID 86671039HCID 86671039, compound

Product 1

HCID 86671051HCID 86671051, compound

Sources & evidence

ORD record
ord-4153a0d0eafe4764a05c29cf1f3c36ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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