Hydrochloric Acid → HCID 178524028, compound

HRID 1555394Notes

Reaction equation

HRID 1555394 reaction equation
[CH3:43][O:44][CH2:45][CH2:46][O:47][CH3:48].[ClH:42].[F:29][C:30]([c:31]1[c:32]([B:37]([OH:38])[OH:39])[cH:33][cH:34][cH:35][cH:36]1)([F:40])[F:41].[I:1][c:2]1[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH:12]([C:20](=[O:21])[OH:22])[CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]32)[cH:6][cH:7]1.[Na+:23].[Na+:24].[O-:25][C:26](=[O:27])[O-:28].[OH2:49]>>[c:2]1(-[c:32]2[c:31]([C:30]([F:29])([F:40])[F:41])[cH:36][cH:35][cH:34][cH:33]2)[cH:3][cH:4][c:5]([S:8](=[O:9])(=[O:10])[N:11]2[CH:12]([C:20](=[O:21])[OH:22])[CH2:13][c:14]3[cH:15][cH:16][cH:17][cH:18][c:19]32)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 19660Carbonate IonHCID 27343872-(Trifluoromethyl)benzeneboronic acidHCID 178524029HCID 178524029, compound

Product 1

HCID 178524028HCID 178524028, compound

Sources & evidence

ORD record
ord-f3dd338f37a0441c9f04a78c3410c289
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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