Hydrochloric Acid → [1-[(2-amino-2,3-dihydro-1H-inden-5-yl)methyl]-3-(trifluoromethyl)pyrazol-4-yl]methanol

HRID 116227Notes

Reaction equation

HRID 116227 reaction equation
[CH3:33][CH2:34][OH:35].[Cl:39][CH2:40][Cl:41].[ClH:36].[H:37][H:38].[OH-:42].[OH-:44].[OH:1][CH2:2][c:3]1[c:4]([C:29]([F:30])([F:31])[F:32])[n:5][n:6]([CH2:8][c:9]2[cH:10][c:11]3[c:15]([cH:16][cH:17]2)[CH2:14][CH:13]([NH:18][C:19](=[O:20])[O:21][CH2:22][c:23]2[cH:24][cH:25][cH:26][cH:27][cH:28]2)[CH2:12]3)[cH:7]1.[Pd+2:43]>>[OH:1][CH2:2][c:3]1[c:4]([C:29]([F:30])([F:31])[F:32])[n:5][n:6]([CH2:8][c:9]2[cH:10][c:11]3[c:15]([cH:16][cH:17]2)[CH2:14][CH:13]([NH2:18])[CH2:12]3)[cH:7]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 702EthanolHCID 961Hydroxide2×HCID 6344DichloromethaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 178418361HCID 178418361, compoundHCID 178521719HCID 178521719, compound

Product 1

HCID 67088047[1-[(2-amino-2,3-dihydro-1H-inden-5-yl)methyl]-3-(trifluoromethyl)pyrazol-4-yl]methanol

Sources & evidence

ORD record
ord-8d56458650ef4bb38bcf08e32fa28573
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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