Bicarbonate Ion → HCID 57443527, compound

HRID 176037

Reaction equation

HRID 176037 reaction equation
[C:49](=[O:50])([OH:51])[O-:52].[CH2:1]([CH3:2])[C:3]([C:4]#[CH:5])([CH2:6][CH3:7])[OH:8].[CH3:12][O:13][C:14]([CH2:15][c:16]1[cH:17][n:18][cH:19][c:20](-[c:22]2[cH:23][cH:24][c:25]([C:28]([CH2:29][CH3:30])([c:31]3[cH:32][c:33]([CH3:45])[c:34]([O:37][S:38]([C:39]([F:40])([F:41])[F:42])(=[O:43])=[O:44])[cH:35][cH:36]3)[CH2:46][CH3:47])[cH:26][cH:27]2)[cH:21]1)=[O:48].[CH3:54][CH2:55][N:56]([CH2:57][CH3:58])[CH2:59][CH3:60].[Cl:9][CH2:10][Cl:11].[Cu:61][I:62].[Na+:53]>>[CH2:1]([CH3:2])[C:3]([C:4]#[C:5][c:34]1[c:33]([CH3:45])[cH:32][c:31]([C:28]([c:25]2[cH:24][cH:23][c:22](-[c:20]3[cH:19][n:18][cH:17][c:16]([CH2:15][C:14]([O:13][CH3:12])=[O:48])[cH:21]3)[cH:27][cH:26]2)([CH2:29][CH3:30])[CH2:46][CH3:47])[cH:36][cH:35]1)([CH2:6][CH3:7])[OH:8]

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 8471TriethylamineHCID 226983-Ethyl-1-pentyn-3-olHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 57709113(5-{4-[1-Ethyl-1-(3-methyl-4-trifluoromethanesulfonyloxy-phenyl)-propyl]-phenyl}-pyridin-3-yl)-acetic acid methyl ester

Product 1

HCID 57443527HCID 57443527, compound

Sources & evidence

ORD record
ord-b48282a3cba94313aa4e99110ad077c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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