Dimethylformamide → 5-Nitroindole-2-carboxylic acid

HRID 122329

Reaction equation

HRID 122329 reaction equation
[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[nH:7][c:8]2[cH:9][cH:10][c:11]([N+:15](=[O:16])[O-:17])[cH:12][c:13]2[cH:14]1.[CH:18]([N:19]([CH2:20][CH3:21])[CH:22]([CH3:23])[CH3:24])([CH3:25])[CH3:26].[Cl:67][CH2:68][Cl:69].[F:60][C:61]([F:62])([F:63])[C:64]([OH:65])=[O:66].[O:70]=[CH:71][N:72]([CH3:73])[CH3:74].[P-:27]([F:28])([F:29])([F:30])([F:31])([F:32])[F:33].[n:34]1([O:35][P+:36]([N:37]2[CH2:38][CH2:39][CH2:40][CH2:41]2)([N:42]2[CH2:43][CH2:44][CH2:45][CH2:46]2)[N:47]2[CH2:48][CH2:49][CH2:50][CH2:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][c:57]2[n:58][n:59]1>>[O:3]=[C:4]([OH:5])[c:6]1[nH:7][c:8]2[cH:9][cH:10][c:11]([N+:15](=[O:16])[O-:17])[cH:12][c:13]2[cH:14]1

Participants

8

Reactant 7

HCID 6228DimethylformamideHCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 9886HexafluorophosphateHCID 81531DiisopropylethylamineHCID 280312Ethyl 5-nitro-1H-indole-2-carboxylateHCID 2724700Benzotriazol-1-yl-oxytripyrrolidinophosphonium

Product 1

HCID 3512915-Nitroindole-2-carboxylic acid

Sources & evidence

ORD record
ord-e1c396a709fe4bddaba6be57e3de25e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

Loading…