Dichloroacetyl chloride → HCID 68678353, compound

HRID 679063Notes

Reaction equation

HRID 679063 reaction equation
[CH:46]([N:47]([CH2:48][CH3:49])[CH:50]([CH3:51])[CH3:52])([CH3:53])[CH3:54].[Cl:40][CH:41]([C:42](=[O:43])[Cl:44])[Cl:45].[NH2:1][C:2]([C:3](=[O:4])[N:5]1[CH2:6][CH2:7][C:8]([CH2:11][CH2:12][N:13]2[CH:14]3[CH2:15][CH:16]([n:21]4[c:22]([CH3:30])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[CH2:17][CH:18]2[CH2:19][CH2:20]3)([c:31]2[cH:32][c:33]([F:37])[cH:34][cH:35][cH:36]2)[CH2:9][CH2:10]1)([CH3:38])[CH3:39]>>[NH:1]([C:2]([C:3](=[O:4])[N:5]1[CH2:6][CH2:7][C:8]([CH2:11][CH2:12][N:13]2[CH:14]3[CH2:15][CH:16]([n:21]4[c:22]([CH3:30])[n:23][c:24]5[c:25]4[cH:26][cH:27][cH:28][cH:29]5)[CH2:17][CH:18]2[CH2:19][CH2:20]3)([c:31]2[cH:32][c:33]([F:37])[cH:34][cH:35][cH:36]2)[CH2:9][CH2:10]1)([CH3:38])[CH3:39])[C:42]([CH:41]([Cl:40])[Cl:45])=[O:43]

Participants

4

Reactant 3

HCID 6593Dichloroacetyl chlorideHCID 81531DiisopropylethylamineHCID 68676858HCID 68676858, compound

Product 1

HCID 68678353HCID 68678353, compound

Sources & evidence

ORD record
ord-824d6613747e49689a823d66104c12e9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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