1,2-Dichloroethane → HCID 18449227, compound

HRID 2151524Notes

Reaction equation

HRID 2151524 reaction equation
[CH2:90]([Cl:91])[CH2:92][Cl:93].[CH3:23][c:24]1[cH:25][cH:26][cH:27][c:28]([C:30](=[O:31])[OH:32])[n:29]1.[CH3:82][OH:83].[CH3:84][CH2:85][O:86][C:87]([CH3:88])=[O:89].[CH3:94][CH2:95][N:96]([CH2:97][CH3:98])[CH2:99][CH3:100].[F:1][c:2]1[cH:3][cH:4][c:5]2[n:6][c:7]([NH:16][CH:17]3[CH2:18][CH2:19][NH:20][CH2:21][CH2:22]3)[c:8]3[n:9]([c:10]2[cH:11]1)[c:12](=[O:15])[nH:13][n:14]3.[O:76]=[CH:77][N:78]([CH3:79])[CH3:80].[OH2:81].[OH:33][n:34]1[c:35]2[c:36]([cH:37][cH:38][cH:39][cH:40]2)[n:41][n:42]1.[P-:43]([F:44])([F:45])([F:46])([F:47])([F:48])[F:49].[n:50]1([O:51][P+:52]([N:53]2[CH2:54][CH2:55][CH2:56][CH2:57]2)([N:58]2[CH2:59][CH2:60][CH2:61][CH2:62]2)[N:63]2[CH2:64][CH2:65][CH2:66][CH2:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][c:73]2[n:74][n:75]1>>[F:1][c:2]1[cH:3][cH:4][c:5]2[n:6][c:7]([NH:16][CH:17]3[CH2:18][CH2:19][N:20]([C:30]([c:28]4[cH:27][cH:26][cH:25][c:24]([CH3:23])[n:29]4)=[O:31])[CH2:21][CH2:22]3)[c:8]3[n:9]([c:10]2[cH:11]1)[c:12](=[O:15])[nH:13][n:14]3

Participants

12

Reactant 11

HCID 111,2-DichloroethaneHCID 887MethanolHCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 9886HexafluorophosphateHCID 702826-Methylpyridine-2-carboxylic acidHCID 757711-HydroxybenzotriazoleHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphoniumHCID 10017782HCID 10017782, compound

Product 1

HCID 18449227HCID 18449227, compound

Sources & evidence

ORD record
ord-a824612481a54802a389701bf9e54100
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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