Bicarbonate Ion → HCID 178444940, compound

HRID 692209Notes

Reaction equation

HRID 692209 reaction equation
[CH:31]([N:32]([CH2:33][CH3:34])[CH:35]([CH3:36])[CH3:37])([CH3:38])[CH3:39].[Cl:69][CH2:70][Cl:71].[N:1](=[N+:2]=[N-:3])[CH2:4][CH:5]([NH2:6])[c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][CH:15]([CH2:16][CH2:17][CH3:18])[CH3:19])[cH:11][cH:12]1.[Na+:68].[O-:64][C:65]([OH:66])=[O:67].[P-:40]([F:41])([F:42])([F:43])([F:44])([F:45])[F:46].[c:20]1([CH:26]([C:27](=[O:28])[OH:29])[CH3:30])[cH:21][cH:22][cH:23][cH:24][cH:25]1.[n:47]1([O:48][C:49]([N:50]([CH3:51])[CH3:52])=[N+:53]([CH3:54])[CH3:55])[c:56]2[n:57][cH:58][cH:59][cH:60][c:61]2[n:62][n:63]1>>[N:1](=[N+:2]=[N-:3])[CH2:4][CH:5]([NH:6][C:27]([CH:26]([c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1)[CH3:30])=[O:28])[c:7]1[cH:8][cH:9][c:10]([O:13][CH2:14][CH:15]([CH2:16][CH2:17][CH3:18])[CH3:19])[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 9886HexafluorophosphateHCID 102962-Phenylpropionic acidHCID 81531DiisopropylethylamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminiumHCID 178444953HCID 178444953, compound

Product 1

HCID 178444940HCID 178444940, compound

Sources & evidence

ORD record
ord-e121a7d1061a4bf291a98abe86f8fa7f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…