Chloride → HCID 53734757, compound

HRID 665923Notes

Reaction equation

HRID 665923 reaction equation
[C:41]([BH3-:42])#[N:43].[C:45](=[O:46])([O-:47])[OH:48].[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH3:53][OH:54].[Cl-:55].[Cl-:57].[Cl-:58].[Cl-:59].[Cl:50][CH2:51][Cl:52].[F:19][c:20]1[cH:21][cH:22][c:23]([C:26]([CH2:27][n:28]2[cH:29][n:30][cH:31][cH:32]2)=[O:33])[cH:24][cH:25]1.[NH2:1][c:2]1[cH:3][c:4](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1.[Na+:44].[Na+:49].[Ti+4:56]>>[NH:1]([c:2]1[cH:3][c:4](-[c:12]2[cH:13][cH:14][c:15]([F:18])[cH:16][cH:17]2)[c:5]([C:6](=[O:7])[O:8][CH3:9])[cH:10][cH:11]1)[CH:26]([c:23]1[cH:22][cH:21][c:20]([F:19])[cH:25][cH:24]1)[CH2:27][n:28]1[cH:29][n:30][cH:31][cH:32]1

Participants

11

Reactant 10

HCID 312Chloride4×HCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ion2×HCID 6344DichloromethaneHCID 8471TriethylamineHCID 114942Titanium cation (4+)HCID 498716Cyano-borohydrideHCID 51512791-(4-fluorophenyl)-2-(1H-imidazol-1-yl)ethan-1-oneHCID 18476027HCID 18476027, compound

Product 1

HCID 53734757HCID 53734757, compound

Sources & evidence

ORD record
ord-ced88e0e1a134e20862a4d8543337e59
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…