Water → HCID 53852052, compound

HRID 1227003Notes

Reaction equation

HRID 1227003 reaction equation
[C:13]([CH2:14][CH3:15])(=[O:16])[O:17][CH3:18].[CH2:19]([CH2:20][CH2:21][CH3:22])[c:23]1[n:24]([CH2:39][c:40]2[c:41]([Cl:46])[cH:42][cH:43][cH:44][cH:45]2)[c:25]([CH:37]=[O:38])[c:26]([CH2:28][O:29][Si:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[CH3:36])[n:27]1.[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH2:79]([Cl:80])[Cl:81].[CH3:47][N:48]([c:49]1[cH:50][cH:51][cH:52][cH:53][n:54]1)[CH3:55].[CH3:56][C:57]([O:58][C:59](=[O:60])[CH3:61])=[O:62].[CH3:82][c:83]1[cH:84][cH:85][cH:86][cH:87][cH:88]1.[CH3:89][CH2:90][CH2:91][CH2:92][CH2:93][CH3:94].[CH3:95][CH2:96][O:97][C:98](=[O:99])[CH3:100].[CH:6]([NH:7][CH:8]([CH3:9])[CH3:10])([CH3:11])[CH3:12].[N:63]12[CH2:64][CH2:65][CH2:66][N:67]=[C:68]1[CH2:69][CH2:70][CH2:71][CH2:72][CH2:73]2.[O:74]1[CH2:75][CH2:76][CH2:77][CH2:78]1.[OH2:101]>>[C:13]([CH:14]=[CH:15][c:25]1[n:24]([CH2:39][c:40]2[c:41]([Cl:46])[cH:42][cH:43][cH:44][cH:45]2)[c:23]([CH2:19][CH2:20][CH2:21][CH3:22])[n:27][c:26]1[CH2:28][O:29][Si:30]([CH3:31])([CH3:32])[C:33]([CH3:34])([CH3:35])[CH3:36])(=[O:16])[O:17][CH3:18]

Participants

14

Reactant 13

HCID 962WaterHCID 1140TolueneHCID 6344DichloromethaneHCID 7912DiisopropylamineHCID 7918Acetic AnhydrideHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8857Ethyl AcetateHCID 11124Methyl propionateHCID 218852-DimethylaminopyridineHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 19936873HCID 19936873, compoundHCID 178418339Butyllithium

Product 1

HCID 53852052HCID 53852052, compound

Sources & evidence

ORD record
ord-d7be0d379e7e421a89c6eeabfa6a5ca7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…