Ethanol → HCID 11648671, compound

HRID 1113374Notes

Reaction equation

HRID 1113374 reaction equation
[CH2:1]([O:2][C:4](=[O:5])[c:6]1[cH:7][c:8]2[c:9]([nH:10]1)[cH:11][c:12](-[c:14]1[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]1)[o:13]2)[CH3:3].[CH2:21]([O:22][C:23](=[O:24])[CH:25]([CH2:26][CH3:27])[CH2:28][CH2:29][N:30]1[C:31](=[S:32])[n:33]2[c:34]3[cH:35][c:36](-[c:37]4[cH:38][cH:39][c:40]([Cl:41])[cH:42][cH:43]4)[o:44][c:45]3[cH:46][c:47]2[C:48]1=[O:49])[CH3:50].[CH2:51]([CH3:52])[O:53][P:54]([O:55][CH2:56][CH3:57])(=[O:58])[CH2:59][CH2:60][CH2:61][N:62]=[C:63]=[S:64].[CH3:71][CH2:72][OH:73].[K+:65].[K+:66].[O-:67][C:68]([O-:69])=[O:70]>>[C:4]1(=[O:5])[c:6]2[cH:7][c:8]3[c:9]([n:10]2[C:63](=[S:64])[N:62]1[CH2:61][CH2:60][CH2:59][P:54]([O:53][CH2:51][CH3:52])([O:55][CH2:56][CH3:57])=[O:58])[cH:11][c:12](-[c:14]1[cH:15][cH:16][c:17]([Cl:20])[cH:18][cH:19]1)[o:13]3

Participants

7

Reactant 6

HCID 702EthanolHCID 813Potassium Cation2×HCID 19660Carbonate IonHCID 12527106HCID 12527106, compoundHCID 86618329HCID 86618329, compoundHCID 86618336HCID 86618336, compound

Product 1

HCID 11648671HCID 11648671, compound

Sources & evidence

ORD record
ord-db2dbf35c8a045cebc707ddf92eb70f0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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