1,1,2,2-Tetrachloroethane → Hydrochloric Acid

HRID 1218734Notes

Reaction equation

HRID 1218734 reaction equation
[CH2:32]([CH3:33])[N:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1.[CH3:25][CH2:26][N:27]([CH2:28][CH3:29])[CH2:30][CH3:31].[CH:1]1([CH:7]2[CH2:8][O:9][c:10]3[c:11]4[n:12]2[cH:13][cH:14][c:15]4[cH:16][cH:17][cH:18]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[Cl:19][C:20]([C:22]([Cl:21])=[O:23])=[O:24].[Cl:40][CH:41]([CH:42]([Cl:43])[Cl:44])[Cl:45]>>[CH:1]1([CH:7]2[CH2:8][O:9][c:10]3[c:11]4[n:12]2[cH:13][c:14]([C:22](=[O:23])[N:37]2[CH2:36][CH2:35][N:34]([CH2:32][CH3:33])[CH2:39][CH2:38]2)[c:15]4[cH:16][cH:17][cH:18]3)[CH2:2][CH2:3][CH2:4][CH2:5][CH2:6]1.[ClH:19]

Participants

7

Reactant 5

HCID 65911,1,2,2-TetrachloroethaneHCID 8471TriethylamineHCID 65578Oxalyl chlorideHCID 791961-EthylpiperazineHCID 178419789HCID 178419789, compound

Product 2

HCID 313Hydrochloric AcidHCID 49862509(11-Cyclohexyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraen-3-yl)-(4-ethylpiperazin-1-yl)methanone

Sources & evidence

ORD record
ord-c09fb870995648d2a3732a8208a9a891
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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