Toluene → 2-methyl-N-[3,5-bis(trifluoromethyl)phenylmethylene]-2H-tetrazole-5-amine

Reaction equation

[CH3:31][c:32]1[cH:33][cH:34][cH:35][cH:36][cH:37]1.[F:15][C:16]([c:17]1[cH:18][c:19]([CH:20]=[O:21])[cH:22][c:23]([C:25]([F:26])([F:27])[F:28])[cH:24]1)([F:29])[F:30].[NH2:1][c:2]1[n:3][n:4][n:5]([CH3:7])[n:6]1.[NH2:8][c:9]1[n:10]([CH3:11])[n:12][n:13][n:14]1>>[N:1]([c:2]1[n:3][n:4][n:5]([CH3:7])[n:6]1)=[CH:20][c:19]1[cH:18][c:17]([C:16]([F:15])([F:29])[F:30])[cH:24][c:23]([C:25]([F:26])([F:27])[F:28])[cH:22]1

Participants

Reactant 4

HCID 1140Toluene

HCID 1362473,5-Bis(trifluoromethyl)benzaldehyde

HCID 1384921-methyl-1H-tetrazol-5-amine

HCID 1386772-methyl-2H-1,2,3,4-tetrazol-5-amine

Product 1

HCID 766457252-methyl-N-[3,5-bis(trifluoromethyl)phenylmethylene]-2H-tetrazole-5-amine

Sources & evidence

ORD record: ord-de4acf5aa50a4c1891bc862174d6124a
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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