Ammonium → HCID 69324637, compound

HRID 671545Notes

Reaction equation

HRID 671545 reaction equation
[CH2:31]1[O:32][CH2:33][CH2:34][CH2:35]1.[CH3:38][CH2:39][OH:40].[Cl-:36].[N+:1]([O-:2])(=[O:3])[c:4]1[cH:5][cH:6][c:7]([C:10]23[CH2:11][CH:12]4[CH2:13][CH:14]([CH2:15][C:16]4([NH:18][CH2:19][C:20](=[O:21])[N:22]4[CH:23]([C:27]#[N:28])[CH2:24][CH2:25][CH2:26]4)[CH2:17]2)[CH2:29]3)[cH:8][cH:9]1.[NH4+:37].[OH2:30]>>[NH2:1][c:4]1[cH:5][cH:6][c:7]([C:10]23[CH2:11][CH:12]4[CH2:13][CH:14]([CH2:15][C:16]4([NH:18][CH2:19][C:20](=[O:21])[N:22]4[CH:23]([C:27]#[N:28])[CH2:24][CH2:25][CH2:26]4)[CH2:17]2)[CH2:29]3)[cH:8][cH:9]1

Participants

7

Reactant 6

HCID 223AmmoniumHCID 312ChlorideHCID 702EthanolHCID 962WaterHCID 8028TetrahydrofuranHCID 178509984HCID 178509984, compound

Product 1

HCID 69324637HCID 69324637, compound

Sources & evidence

ORD record
ord-f8dfd772e8d646d48779e31d7f98c3bf
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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