Bromide ion → 5-(3,5-Di-tert-butyl-4-hydroxyphenyl)-1,3,4-thiadiazole-2(3H)-thione

HRID 2344096Notes

Reaction equation

HRID 2344096 reaction equation
[Br-:31].[Br-:33].[CH2:28]([Cl:29])[Cl:30].[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](-[c:22]2[n:23][nH:24][c:25](=[S:27])[s:26]2)[cH:8][c:9]([C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]1[O:11][CH2:12][O:13][CH2:14][CH2:15][O:16][CH3:17].[Zn+2:32]>>[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[cH:6][c:7](-[c:22]2[n:23][nH:24][c:25](=[S:27])[s:26]2)[cH:8][c:9]([C:18]([CH3:19])([CH3:20])[CH3:21])[c:10]1[OH:11]

Participants

5

Reactant 4

HCID 259Bromide ion2×HCID 6344DichloromethaneHCID 32051Zinc(2+)HCID 103415325-[3,5-bis(1,1-dimethylethyl)-4-[(2-methoxyethoxy)methoxy]phenyl]-1,3,4-thiadiazole-2(3H)-thione

Product 1

HCID 30370185-(3,5-Di-tert-butyl-4-hydroxyphenyl)-1,3,4-thiadiazole-2(3H)-thione

Sources & evidence

ORD record
ord-88aad20454d149eeace72306cb1339d2
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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