Hydrochloric Acid → HCID 20475372, compound

HRID 1209126Notes

Reaction equation

HRID 1209126 reaction equation
[CH2:51]1[O:52][CH2:53][CH2:54][CH2:55]1.[CH3:15][c:16]1[c:17](-[c:18]2[cH:19][cH:20][cH:21][cH:22][n:23]2)[n:24][c:25]([CH3:26])[cH:27][cH:28]1.[CH3:1][c:2]1[cH:3][c:4](-[c:9]2[n:10][cH:11][cH:12][cH:13][cH:14]2)[n:5][c:6]([CH3:8])[cH:7]1.[CH3:29][c:30]1[c:31](-[c:32]2[cH:33][cH:34][cH:35][cH:36][n:37]2)[n:38][cH:39][c:40]([CH3:41])[cH:42]1.[CH3:56][CH2:57][CH2:58][CH2:59][CH2:60][CH3:61].[CH3:85][N:86]([CH3:87])[P:88](=[O:89])([N:90]([CH3:91])[CH3:92])[N:93]([CH3:94])[CH3:95].[CH:43]([N-:44][CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[CH:62]([NH:63][CH:64]([CH3:65])[CH3:66])([CH3:67])[CH3:68].[Cl:69][CH2:70][O:71][CH2:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1.[ClH:79].[Li+:50].[O:80]1[CH2:81][CH2:82][CH2:83][CH2:84]1>>[CH2:1]([c:2]1[cH:3][c:4](-[c:9]2[n:10][cH:11][cH:12][cH:13][cH:14]2)[n:5][c:6]([CH3:8])[cH:7]1)[CH2:70][O:71][CH2:72][c:73]1[cH:74][cH:75][cH:76][cH:77][cH:78]1

Participants

12

Reactant 11

HCID 313Hydrochloric AcidHCID 7912DiisopropylamineHCID 8028Tetrahydrofuran2×HCID 8058HexaneHCID 12679HexamethylphosphoramideHCID 28486Lithium ionHCID 137983Benzyl chloromethyl etherHCID 5062348DiisopropylamideHCID 11008603HCID 11008603, compoundHCID 12232398HCID 12232398, compoundHCID 12232399HCID 12232399, compound

Product 1

HCID 20475372HCID 20475372, compound

Sources & evidence

ORD record
ord-7acb0ea7d5c8467a8a8d505ad65b8479
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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