Bicarbonate Ion → 2-(4-{1-Ethyl-1-[3-methyl-4-(1-trimethylsilanyloxy-cyclopentylethynyl)-phenyl]-propyl}-2-methyl-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

HRID 282649Notes

Reaction equation

HRID 282649 reaction equation
[C:57](=[O:58])([OH:59])[O-:60].[CH2:9]([CH3:10])[C:11]([CH2:12][CH3:13])([c:14]1[cH:15][c:16]([CH3:29])[c:17]([B:20]2[O:21][C:22]([CH3:27])([CH3:28])[C:23]([CH3:25])([CH3:26])[O:24]2)[cH:18][cH:19]1)[c:30]1[cH:31][c:32]([CH3:44])[c:33]([C:36]#[C:37][C:38]2([OH:43])[CH2:39][CH2:40][CH2:41][CH2:42]2)[cH:34][cH:35]1.[Cl:62][CH2:63][Cl:64].[Na+:61].[S:45]([O:46][Si:53]([CH3:54])([CH3:55])[CH3:56])([C:47]([F:48])([F:49])[F:50])(=[O:51])=[O:52].[n:1]1[c:2]([CH3:3])[cH:4][cH:5][cH:6][c:7]1[CH3:8]>>[CH2:9]([CH3:10])[C:11]([CH2:12][CH3:13])([c:14]1[cH:15][c:16]([CH3:29])[c:17]([B:20]2[O:21][C:22]([CH3:27])([CH3:28])[C:23]([CH3:25])([CH3:26])[O:24]2)[cH:18][cH:19]1)[c:30]1[cH:31][c:32]([CH3:44])[c:33]([C:36]#[C:37][C:38]2([O:43][Si:53]([CH3:54])([CH3:55])[CH3:56])[CH2:39][CH2:40][CH2:41][CH2:42]2)[cH:34][cH:35]1

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 79372,6-LutidineHCID 65367Trimethylsilyl triflateHCID 57708931HCID 57708931, compound

Product 1

HCID 577089762-(4-{1-Ethyl-1-[3-methyl-4-(1-trimethylsilanyloxy-cyclopentylethynyl)-phenyl]-propyl}-2-methyl-phenyl)-4,4,5,5-tetramethyl-[1,3,2]dioxaborolane

Sources & evidence

ORD record
ord-b1a82335af9c499aa82a2e69afef2f56
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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