Benzene → Diethatyl-ethyl

HRID 167411Notes

Reaction equation

HRID 167411 reaction equation
[CH2:1]([CH3:2])[c:3]1[c:4]([NH:5][CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[c:12]([CH2:16][CH3:17])[cH:13][cH:14][cH:15]1.[CH3:24][CH2:25][N:26]([CH2:27][CH3:28])[CH2:29][CH3:30].[Cl-:18].[Cl:19][CH2:20][C:21](=[O:22])[OH:23].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[CH2:1]([CH3:2])[c:3]1[c:4]([N:5]([CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[C:21]([CH2:20][Cl:19])=[O:22])[c:12]([CH2:16][CH3:17])[cH:13][cH:14][cH:15]1

Participants

6

Reactant 5

HCID 241BenzeneHCID 300Chloroacetic AcidHCID 312ChlorideHCID 8471TriethylamineHCID 170107Glycine, N-(2,6-diethylphenyl)-, ethyl ester

Product 1

HCID 38090Diethatyl-ethyl

Sources & evidence

ORD record
ord-5ba6121efca849c3b6572c9bf257ea8f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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