Bicarbonate Ion → 4'-Benzyloxy-biphenyl-3-carboxylic acid ethyl ester

HRID 311449

Reaction equation

HRID 311449 reaction equation
[BH:19]([OH:20])[OH:21].[C:42](=[O:43])([OH:44])[O-:45].[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][c:7]([I:11])[cH:8][cH:9][cH:10]1)=[O:12].[CH2:22]([c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1)[O:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[CH3:36][O:37][CH2:38][CH2:39][O:40][CH3:41].[Na+:13].[Na+:14].[Na+:46].[O-:15][C:16](=[O:17])[O-:18]>>[CH2:1]([CH3:2])[O:3][C:4]([c:5]1[cH:6][c:7](-[c:33]2[cH:32][cH:31][c:30]([O:29][CH2:22][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[cH:35][cH:34]2)[cH:8][cH:9][cH:10]1)=[O:12]

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ion3×HCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 61668Boronic AcidHCID 70352Benzyl Phenyl EtherHCID 143542Ethyl 3-iodobenzoate

Product 1

HCID 675281234'-Benzyloxy-biphenyl-3-carboxylic acid ethyl ester

Sources & evidence

ORD record
ord-cce001ecb6464d4194ad58e3777750df
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Linked notes

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