Ammonia → HCID 68552689, compound

HRID 677919Notes

Reaction equation

HRID 677919 reaction equation
[BH4-:31].[CH3:38][CH2:39][OH:40].[CH3:41][CH:42]([CH3:43])[O-:44].[CH3:46][CH:47]([CH3:48])[O-:49].[CH3:50][CH:51]([CH3:52])[O-:53].[CH3:54][CH:55]([CH3:56])[O-:57].[Cl:1][c:2]1[c:3]([O:28][CH3:29])[cH:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([C:14]([CH2:15][n:16]3[n:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([Cl:22])[c:20]3[CH3:21])=[O:27])[CH2:12][CH2:13]2)[cH:6][cH:7]1.[Cl:35][CH2:36][Cl:37].[NH3:30].[NH4+:33].[Na+:32].[OH-:34].[Ti+4:45]>>[Cl:1][c:2]1[c:3]([O:28][CH3:29])[cH:4][c:5]([N:8]2[CH2:9][CH2:10][CH:11]([CH:14]([CH2:15][n:16]3[n:17][c:18]([C:23]([F:24])([F:25])[F:26])[c:19]([Cl:22])[c:20]3[CH3:21])[NH2:30])[CH2:12][CH2:13]2)[cH:6][cH:7]1

Participants

11

Reactant 10

HCID 222AmmoniaHCID 223AmmoniumHCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 6344DichloromethaneHCID 28123BorohydrideHCID 114942Titanium cation (4+)HCID 3260420Isopropanolate4×HCID 24863461HCID 24863461, compound

Product 1

HCID 68552689HCID 68552689, compound

Sources & evidence

ORD record
ord-8d70def155284a00903e93085fbd4e03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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