Hydrochloric Acid → HCID 482696, compound

HRID 1558709Notes

Reaction equation

HRID 1558709 reaction equation
[C:46](=[O:47])([OH:48])[O-:49].[CH3:54][OH:55].[CH3:56][CH2:57][OH:58].[Cl:51][CH2:52][Cl:53].[Cl:60][CH2:61][Cl:62].[ClH:43].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([F:42])[c:7](-[n:10]2[cH:11][c:12]([C:39](=[O:40])[OH:41])[c:13](=[O:38])[c:14]3[cH:15][c:16]([F:37])[c:17]([N:20]4[CH2:21][CH2:22][N:23]([CH2:26][C:27](=[O:28])[c:29]5[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]5)[CH2:24][CH2:25]4)[cH:18][c:19]23)[cH:8][cH:9]1.[NH2:44][OH:45].[Na+:50].[OH2:59]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][c:6]([F:42])[c:7](-[n:10]2[cH:11][c:12]([C:39](=[O:40])[OH:41])[c:13](=[O:38])[c:14]3[cH:15][c:16]([F:37])[c:17]([N:20]4[CH2:21][CH2:22][N:23]([CH2:26][C:27]([c:29]5[cH:30][cH:31][c:32]([O:35][CH3:36])[cH:33][cH:34]5)=[N:44][OH:45])[CH2:24][CH2:25]4)[cH:18][c:19]23)[cH:8][cH:9]1

Participants

10

Reactant 9

HCID 313Hydrochloric AcidHCID 702EthanolHCID 769Bicarbonate IonHCID 787HydroxylamineHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 6344Dichloromethane2×HCID 482688HCID 482688, compound

Product 1

HCID 482696HCID 482696, compound

Sources & evidence

ORD record
ord-f390f219e35149cea4d4fbd11b22da84
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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