Hydrochloric Acid → HCID 59303316, compound

HRID 2136209Notes

Reaction equation

HRID 2136209 reaction equation
[C:60](=[O:61])([O-:62])[OH:63].[CH2:39]([N:40]1[CH2:41][CH2:42][O:43][CH2:44][CH2:45]1)[CH3:46].[CH3:18][N:19]([CH3:20])[CH2:21][CH2:22][CH2:23][N:24]=[C:25]=[N:26][CH2:27][CH3:28].[CH3:68][N:69]([CH3:70])[CH:71]=[O:72].[Cl:47][c:48]1[c:49]([CH2:58][NH2:59])[cH:50][cH:51][cH:52][c:53]1[C:54]([F:55])([F:56])[F:57].[Cl:65][CH2:66][Cl:67].[ClH:17].[Na+:64].[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:14](=[O:15])[OH:16])[N:6]1[CH2:7][c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1.[OH:29][n:30]1[c:31]2[cH:32][cH:33][cH:34][cH:35][c:36]2[n:37][n:38]1>>[O:1]=[C:2]1[CH2:3][CH2:4][CH:5]([C:14](=[O:16])[NH:59][CH2:58][c:49]2[c:48]([Cl:47])[c:53]([C:54]([F:55])([F:56])[F:57])[cH:52][cH:51][cH:50]2)[N:6]1[CH2:7][c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1

Participants

11

Reactant 10

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 7525EthylmorpholineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 3228021-Benzyl-5-oxopyrrolidine-2-carboxylic acidHCID 52242072-Chloro-3-(trifluoromethyl)benzylamine

Product 1

HCID 59303316HCID 59303316, compound

Sources & evidence

ORD record
ord-985af00037b64d81bb4144c0b0329563
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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