Ammonium → HCID 58477511, compound

HRID 677939Notes

Reaction equation

HRID 677939 reaction equation
[CH2:40]1[CH2:43][CH2:42][CH2:41][O:44]1.[Cl-:38].[Cl:46][CH2:47][Cl:48].[NH4+:39].[O:1]=[c:2]1[cH:3][cH:4][c:5](-[c:30]2[cH:31][c:32]([C:33]#[N:34])[cH:35][cH:36][cH:37]2)[n:6][n:7]1[CH2:8][c:9]1[cH:10][c:11](-[c:15]2[n:16][cH:17][c:18]([B:21]3[O:22][C:23]([CH3:24])([CH3:25])[C:26]([CH3:27])([CH3:28])[O:29]3)[cH:19][n:20]2)[cH:12][cH:13][cH:14]1.[OH2:45]>>[O:1]=[c:2]1[cH:3][cH:4][c:5](-[c:30]2[cH:31][c:32]([C:33]#[N:34])[cH:35][cH:36][cH:37]2)[n:6][n:7]1[CH2:8][c:9]1[cH:10][c:11](-[c:15]2[n:16][cH:17][c:18]([OH:44])[cH:19][n:20]2)[cH:12][cH:13][cH:14]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 58477513HCID 58477513, compound

Product 1

HCID 58477511HCID 58477511, compound

Sources & evidence

ORD record
ord-71973f187d8b4ca8b8883e07a95df51b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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