Acetonitrile → Bromide ion

HRID 1150534Notes

Reaction equation

HRID 1150534 reaction equation
[Br:1][CH2:2][c:3]1[n:4][c:5]([CH2:8][CH:9]([CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[o:6][cH:7]1.[CH3:41][C:42]#[N:43].[c:22]1([P:28]([c:29]2[cH:30][cH:31][cH:32][cH:33][cH:34]2)[c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[cH:23][cH:24][cH:25][cH:26][cH:27]1>>[Br-:1].[CH2:2]([c:3]1[n:4][c:5]([CH2:8][CH:9]([CH2:10][C:11](=[O:12])[O:13][CH2:14][CH3:15])[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[o:6][cH:7]1)[P+:28]([c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1)([c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1)[c:35]1[cH:36][cH:37][cH:38][cH:39][cH:40]1

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 11776TriphenylphosphineHCID 23389064Ethyl (+/-)-4-(4-bromomethyl-1,3-oxazol-2-yl)-3-phenylbutanoate

Product 2

HCID 259Bromide ionHCID 18419549[2-(4-Ethoxy-4-oxo-2-phenylbutyl)-1,3-oxazol-4-yl]methyl-triphenylphosphanium

Sources & evidence

ORD record
ord-92a0fc65defc4794b7920aa1a40d67b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

Loading…