Hydrochloric Acid → HCID 58566337, compound

HRID 99852Notes

Reaction equation

HRID 99852 reaction equation
[CH3:35][OH:36].[CH3:45][CH2:46][O:47][C:48]([CH3:49])=[O:50].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH2:19][O:20][c:21]3[cH:22][cH:23][c:24]([CH2:27][CH:28]([C:29](=[O:30])[O:31][CH2:32][CH3:33])[CH3:34])[cH:25][cH:26]3)[c:11]3[c:12]([cH:18]2)[CH2:13][C:14]([CH3:16])([CH3:17])[O:15]3)[cH:6][cH:7]1.[ClH:39].[Li+:37].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH-:38].[OH2:51]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([CH2:19][O:20][c:21]3[cH:22][cH:23][c:24]([CH2:27][CH:28]([C:29](=[O:30])[OH:31])[CH3:34])[cH:25][cH:26]3)[c:11]3[c:12]([cH:18]2)[CH2:13][C:14]([CH3:16])([CH3:17])[O:15]3)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 961HydroxideHCID 962WaterHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 67406232Ethyl 3-(4-((5-(4-chlorophenyl)-2,2-dimethyl-2,3-dihydrobenzofuran-7-yl)methoxy)phenyl)-2-methylpropanoate

Product 1

HCID 58566337HCID 58566337, compound

Sources & evidence

ORD record
ord-a5c41a6584ec43f5a72c7d8a1c3346d6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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