1,2-Dichloroethane → HCID 178423794, compound

HRID 1114431Notes

Reaction equation

HRID 1114431 reaction equation
[CH2:34]([Cl:35])[CH2:36][Cl:37].[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:22](=[O:23])[OH:24])[cH:11][c:12]([C:14]3=[N:15][O:16][C:17]4([CH2:18][CH2:19][CH2:20]4)[CH2:21]3)[cH:13]2)[cH:6][cH:7]1.[CH3:38][CH2:39][N:40]([CH2:41][CH3:42])[CH2:43][CH3:44].[CH3:50][N:51]([CH3:52])[CH:53]=[O:54].[ClH:25].[Na+:49].[O-:45][C:46]([OH:47])=[O:48].[n:26]1[n:27][c:28]([CH:31]([CH3:32])[NH2:33])[nH:29][cH:30]1>>[CH3:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][c:10]([C:22](=[O:23])[NH:33][CH:31]([c:28]3[n:27][n:26][cH:30][nH:29]3)[CH3:32])[cH:11][c:12]([C:14]3=[N:15][O:16][C:17]4([CH2:18][CH2:19][CH2:20]4)[CH2:21]3)[cH:13]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 923Sodium ionHCID 6228DimethylformamideHCID 8471TriethylamineHCID 668957974'-Methyl-5-(5-oxa-6-azaspiro[3.4]oct-6-en-7-yl)biphenyl-3-carboxylic acidHCID 178463648HCID 178463648, compound

Product 1

HCID 178423794HCID 178423794, compound

Sources & evidence

ORD record
ord-72b790a6c120427aaabfc5fc3e75db5c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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