Bicarbonate Ion → HCID 22177842, compound

HRID 163544Notes

Reaction equation

HRID 163544 reaction equation
[C:24](=[O:25])([OH:26])[O-:27].[CH2:41]([N:42]([CH2:43][CH3:44])[c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1)[CH3:51].[CH3:34][c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1.[Na+:28].[OH:1][c:2]1[c:3]2[c:4]([n:5][c:6]3[n:7]1[n:8][c:9]([CH3:20])[c:10]3-[c:11]1[c:12]([CH3:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)[CH2:21][CH2:22][CH2:23]2.[P:29]([Cl:30])([Cl:31])([Cl:32])=[O:33]>>[c:2]1([Cl:31])[c:3]2[c:4]([n:5][c:6]3[n:7]1[n:8][c:9]([CH3:20])[c:10]3-[c:11]1[c:12]([CH3:19])[cH:13][c:14]([O:17][CH3:18])[cH:15][cH:16]1)[CH2:21][CH2:22][CH2:23]2

Participants

7

Reactant 6

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 7061N,N-DiethylanilineHCID 24813Phosphorus oxychlorideHCID 178488681HCID 178488681, compound

Product 1

HCID 22177842HCID 22177842, compound

Sources & evidence

ORD record
ord-5ff7ce6a269647eaab4b502185e9ca07
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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