Acetonitrile → Chloride

HRID 147583Notes

Reaction equation

HRID 147583 reaction equation
[CH3:31][C:32]#[N:33].[Cl:24][CH2:25][CH2:26][O:27][CH2:28][CH2:29][Cl:30].[NH:1]1[CH2:2][CH:3]([O:6][C:7]([C:8]([c:9]2[cH:10][cH:11][cH:12][cH:13][cH:14]2)([OH:15])[CH:16]2[CH2:17][C:18]([F:21])([F:22])[CH2:19][CH2:20]2)=[O:23])[CH2:4][CH2:5]1>>[Cl-:24].[N+:1]12([CH2:2][CH:3]([O:6][C:7]([C:8]([c:9]3[cH:10][cH:11][cH:12][cH:13][cH:14]3)([OH:15])[CH:16]3[CH2:17][C:18]([F:21])([F:22])[CH2:19][CH2:20]3)=[O:23])[CH2:4][CH2:5]1)[CH2:25][CH2:26][O:27][CH2:28][CH2:29]2

Participants

5

Reactant 3

HCID 6342AcetonitrileHCID 8115Bis(2-chloroethyl) etherHCID 22594525HCID 22594525, compound

Product 2

HCID 312ChlorideHCID 178524545HCID 178524545, compound

Sources & evidence

ORD record
ord-71ecf5ffa7ef43f5ad1d2fb65e813da1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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