Acetic Acid → HCID 17931372, compound

HRID 1120241Notes

Reaction equation

HRID 1120241 reaction equation
[CH2:35]1[O:36][CH2:37][CH2:38][CH2:39]1.[CH3:46][C:47](=[O:48])[OH:49].[Cl:42][CH2:43][Cl:44].[Li+:41].[O:1]=[S:2]1(=[O:34])[CH2:3][C:4]([CH2:28][CH3:29])([CH2:30][CH2:31][CH2:32][CH3:33])[CH2:5][N:6]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:7]2[c:8]1[cH:9][c:10]([O:15][CH2:16][C:17](=[O:18])[O:19][CH2:20][CH3:21])[c:11]([S:13][CH3:14])[cH:12]2.[OH-:40].[OH2:45]>>[O:1]=[S:2]1(=[O:34])[CH2:3][C:4]([CH2:28][CH3:29])([CH2:30][CH2:31][CH2:32][CH3:33])[CH2:5][N:6]([c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:7]2[c:8]1[cH:9][c:10]([O:15][CH2:16][C:17](=[O:18])[OH:19])[c:11]([S:13][CH3:14])[cH:12]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 22393123HCID 22393123, compound

Product 1

HCID 17931372HCID 17931372, compound

Sources & evidence

ORD record
ord-57bb6a40e1a24730ae511a5180b972f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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