Ammonium → HCID 66777726, compound

HRID 316939Notes

Reaction equation

HRID 316939 reaction equation
[CH2:30]([CH3:31])[O:32][C:33]([CH2:34][CH2:35][NH2:36])=[O:37].[CH2:50]([N:51]=[C:52]=[N:53][CH2:54][CH2:55][CH2:56][N:57]([CH3:58])[CH3:59])[CH3:60].[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[CH3:68][CH2:69][N:70]([CH2:71][CH3:72])[CH2:73][CH3:74].[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([F:18])[cH:16][cH:17]3)[NH:19][c:20]2[cH:21][cH:22][c:23]([C:26](=[O:27])[OH:28])[cH:24][n:25]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl-:61].[ClH:29].[ClH:49].[NH4+:62].[OH2:38].[OH:39][n:40]1[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2[n:47][n:48]1>>[CH:1]1([CH:7]([c:8]2[o:9][c:10]3[c:11]([c:12]2[CH3:13])[cH:14][c:15]([F:18])[cH:16][cH:17]3)[NH:19][c:20]2[cH:21][cH:22][c:23]([C:26](=[O:27])[NH:36][CH2:35][CH2:34][C:33]([O:32][CH2:30][CH3:31])=[O:37])[cH:24][n:25]2)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1

Participants

11

Reactant 10

HCID 223AmmoniumHCID 312ChlorideHCID 313Hydrochloric Acid2×HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 757711-HydroxybenzotriazoleHCID 419889Ethyl 3-aminopropanoateHCID 66778447HCID 66778447, compound

Product 1

HCID 66777726HCID 66777726, compound

Sources & evidence

ORD record
ord-ee427af3c823415c89ad740d11a92d37
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…