Water → HCID 178454491, compound

HRID 292049Notes

Reaction equation

HRID 292049 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][CH2:6][CH:7]1[CH:8]([OH:40])[CH:9]([O:36][CH2:37][CH2:38][OH:39])[C:10]([n:12]2[cH:13][n:14][c:15]3[c:16](=[O:17])[nH:18][c:19]([NH2:20])[n:21][c:22]23)([SiH:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[O:11]1.[C:52]([CH:53]([CH3:54])[CH3:55])(=[O:56])[Cl:57].[CH3:47][Si:48]([CH3:49])([CH3:50])[Cl:51].[CH3:58][CH2:59][O:60][C:61]([CH3:62])=[O:63].[OH2:64].[cH:41]1[cH:42][cH:43][n:44][cH:45][cH:46]1>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][CH2:6][CH:7]1[CH:8]([OH:40])[CH:9]([O:36][CH2:37][CH2:38][OH:39])[C:10]([n:12]2[cH:13][n:14][c:15]3[c:16](=[O:17])[nH:18][c:19]([NH:20][C:52]([CH:53]([CH3:54])[CH3:55])=[O:56])[n:21][c:22]23)([SiH:23]([c:24]2[cH:25][cH:26][cH:27][cH:28][cH:29]2)[c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[O:11]1

Participants

7

Reactant 6

HCID 962WaterHCID 1049PyridineHCID 6397ChlorotrimethylsilaneHCID 8857Ethyl AcetateHCID 62325Isobutyryl chlorideHCID 178450426HCID 178450426, compound

Product 1

HCID 178454491HCID 178454491, compound

Sources & evidence

ORD record
ord-34e290c2c6f14617b999d62276b9739a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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