Hydrochloric Acid → HCID 178486833, compound

HRID 112890Notes

Reaction equation

HRID 112890 reaction equation
[C:52](=[O:53])([OH:54])[O-:55].[CH3:1][CH2:2][N:3]([CH2:4][CH3:5])[CH2:6][CH3:7].[CH3:8][C:9]([Cl:10])=[O:11].[Cl:14][c:15]1[cH:16][c:17]([F:51])[c:18]([NH:21][c:22]2[n:23][c:24]([N:36]3[CH2:37][CH2:38][CH:39]([N:42]([C:43]([CH:44]4[NH:45][CH2:46][CH2:47][CH2:48]4)=[O:49])[CH3:50])[CH2:40][CH2:41]3)[n:25][c:26]3[cH:27][c:28]([O:34][CH3:35])[c:29]([O:32][CH3:33])[cH:30][c:31]23)[cH:19][cH:20]1.[Cl:57][CH2:58][Cl:59].[ClH:12].[ClH:13].[Na+:56]>>[CH3:8][C:9](=[O:11])[N:45]1[CH:44]([C:43]([N:42]([CH:39]2[CH2:38][CH2:37][N:36]([c:24]3[n:23][c:22]([NH:21][c:18]4[c:17]([F:51])[cH:16][c:15]([Cl:14])[cH:20][cH:19]4)[c:31]4[c:26]([n:25]3)[cH:27][c:28]([O:34][CH3:35])[c:29]([O:32][CH3:33])[cH:30]4)[CH2:41][CH2:40]2)[CH3:50])=[O:49])[CH2:48][CH2:47][CH2:46]1

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6367Acetyl chlorideHCID 8471TriethylamineHCID 178486831HCID 178486831, compound

Product 1

HCID 178486833HCID 178486833, compound

Sources & evidence

ORD record
ord-ac8ff2f2c45a482cac7d0bd39fcc2797
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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