Dichloromethane → (2-Methyl-6-trifluoromethylphenyl)isocyanate

HRID 834588Notes

Reaction equation

HRID 834588 reaction equation
[CH3:1][c:2]1[c:3]([NH2:12])[c:4]([C:8]([F:9])([F:10])[F:11])[cH:5][cH:6][cH:7]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH:13]12[CH2:14][CH:15]3[CH2:16][CH:17]([CH2:18][CH:19]([CH2:20]3)[CH:21]1[N:22]=[C:24]=[O:25])[CH2:23]2.[Cl:26][C:27]([O:28][C:29](=[O:30])[O:31][C:32]([Cl:33])([Cl:34])[Cl:35])([Cl:36])[Cl:37].[Cl:45][CH2:46][Cl:47]>>[CH3:1][c:2]1[c:3]([N:12]=[C:24]=[O:25])[c:4]([C:8]([F:9])([F:10])[F:11])[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 8471TriethylamineHCID 94429TriphosgeneHCID 128826302-IsocyanatoadamantaneHCID 133182332-Amino-3-methylbenzotrifluoride

Product 1

HCID 53750761(2-Methyl-6-trifluoromethylphenyl)isocyanate

Sources & evidence

ORD record
ord-54e7f82e2438426b92f0105a6d44a499
Source dataset
Test data from https://doi.org/10.1039/C8SC04228D

Reaction notes

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