Hydrochloric Acid → 3-(3-Trifluoromethylphenyl)propanoic acid

HRID 1220358Notes

Reaction equation

HRID 1220358 reaction equation
[CH3:2][CH:3]([c:4]1[c:5]2[c:6]([cH:7][cH:8][cH:9][cH:10]2)[cH:11][cH:12][cH:13]1)[NH:14][CH2:15][CH2:16][CH2:17][c:18]1[cH:19][c:20]([C:21]([F:22])([F:23])[F:24])[cH:25][cH:26][cH:27]1.[ClH:1].[F:28][C:29]([c:30]1[cH:31][c:32]([CH:33]=[CH:34][C:35](=[O:36])[OH:37])[cH:38][cH:39][cH:40]1)([F:41])[F:42].[OH-:43].[OH-:45].[Pd+2:44]>>[F:28][C:29]([c:30]1[cH:31][c:32]([CH2:33][CH2:34][C:35](=[O:36])[OH:37])[cH:38][cH:39][cH:40]1)([F:41])[F:42]

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 961Hydroxide2×HCID 855273-Trifluoromethylcinnamic acidHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 6101856N-(1-naphthalen-1-ylethyl)-3-[3-(trifluoromethyl)phenyl]propan-1-amine

Product 1

HCID 27776833-(3-Trifluoromethylphenyl)propanoic acid

Sources & evidence

ORD record
ord-5de80cdc82d74db5a2104bb2a46c6e57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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