Chloride → HCID 56979742, compound

Reaction equation

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

Participants

Reactant 6

HCID 312Chloride

HCID 795Imidazole

HCID 887Methanol

HCID 6342Acetonitrile

HCID 81990Chlorodiphenylacetic acid

HCID 5124031Methyl 2-chloro-2,2-diphenylacetate

Product 1

HCID 56979742HCID 56979742, compound

Sources & evidence

ORD record: ord-0f17d3c4c0164cc686120cbfe9179546
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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