Bicarbonate Ion → HCID 57540720, compound

HRID 1208932Notes

Reaction equation

HRID 1208932 reaction equation
[CH:51]([N:52]([CH2:53][CH3:54])[CH:55]([CH3:56])[CH3:57])([CH3:58])[CH3:59].[F:60][C:61]([O:62][c:63]1[cH:64][cH:65][c:66]([SH:69])[cH:67][cH:68]1)([F:70])[F:71].[Na+:81].[O-:77][C:78]([OH:79])=[O:80].[O:72]=[CH:73][N:74]([CH3:75])[CH3:76].[OH:1][c:2]1[c:3](=[O:17])[n:4]([CH2:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[cH:5][cH:6][n:7]1.[P-:18]([F:19])([F:20])([F:21])([F:22])([F:23])[F:24].[n:25]1([O:26][P+:27]([N:28]2[CH2:29][CH2:30][CH2:31][CH2:32]2)([N:33]2[CH2:34][CH2:35][CH2:36][CH2:37]2)[N:38]2[CH2:39][CH2:40][CH2:41][CH2:42]2)[c:43]2[cH:44][cH:45][cH:46][cH:47][c:48]2[n:49][n:50]1>>[c:2]1([S:69][c:66]2[cH:65][cH:64][c:63]([O:62][C:61]([F:60])([F:70])[F:71])[cH:68][cH:67]2)[c:3](=[O:17])[n:4]([CH2:8][c:9]2[cH:10][cH:11][c:12]([O:15][CH3:16])[cH:13][cH:14]2)[cH:5][cH:6][n:7]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphoniumHCID 27773604-(Trifluoromethoxy)thiophenolHCID 178490807HCID 178490807, compound

Product 1

HCID 57540720HCID 57540720, compound

Sources & evidence

ORD record
ord-531536f7981a4abda062bf434f612d10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…