Acetate → Hydrochloric Acid

HRID 2344840Notes

Reaction equation

HRID 2344840 reaction equation
[C:34]([CH3:35])([CH3:36])([CH3:37])[C:38]#[CH:39].[C:42]([O-:43])(=[O:44])[CH3:45].[C:47]([O-:48])(=[O:49])[CH3:50].[CH2:29]([NH2:30])[CH2:31][CH2:32][CH3:33].[Cl:2][CH:3]=[CH:4][CH2:5][NH:6][CH2:7][CH2:8][CH3:9].[ClH:1].[Cu:40][I:41].[O:51]1[CH2:52][CH2:53][CH2:54][CH2:55]1.[Pd+2:46].[c:10]1([P:11]([c:12]2[cH:13][cH:14][cH:15][cH:16][cH:17]2)[c:18]2[cH:19][cH:20][cH:21][cH:22][cH:23]2)[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[CH:3](=[CH:4][CH2:5][NH:6][CH2:7][CH2:8][CH3:9])[C:39]#[C:38][C:34]([CH3:35])([CH3:36])[CH3:37].[ClH:2]

Participants

11

Reactant 9

HCID 175Acetate2×HCID 313Hydrochloric AcidHCID 8007ButylamineHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 135123,3-Dimethyl-1-butyneHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 539022043-Chloro-N-propylprop-2-en-1-amine

Product 2

HCID 313Hydrochloric AcidHCID 54058913HCID 54058913, compound

Sources & evidence

ORD record
ord-4725c98568ac4790bd91727772a20e9d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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