Hydrogen Bromide → HCID 75230970, compound

HRID 1570131Notes

Reaction equation

HRID 1570131 reaction equation
[Br:35][CH2:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42].[BrH:34].[C:29](=[O:30])([OH:31])[O-:32].[CH3:43][C:44]#[N:45].[CH3:47][CH2:48][O:49][C:50]([CH3:51])=[O:52].[Cl:1][CH:2]1[CH2:3][CH:4]([OH:28])[CH:5]([CH2:18][CH2:19][c:20]2[cH:21][c:22]([Cl:27])[cH:23][c:24]([Cl:26])[cH:25]2)[CH:6]1[CH2:7][CH2:8][CH2:9][c:10]1[cH:11][cH:12][c:13]([C:15](=[O:16])[OH:17])[s:14]1.[K+:33].[OH2:46]>>[Cl:1][CH:2]1[CH2:3][CH:4]([OH:28])[CH:5]([CH2:18][CH2:19][c:20]2[cH:21][c:22]([Cl:27])[cH:23][c:24]([Cl:26])[cH:25]2)[CH:6]1[CH2:7][CH2:8][CH2:9][c:10]1[cH:11][cH:12][c:13]([C:15](=[O:16])[O:17][CH2:36][CH2:37][N:38]([CH2:39][CH3:40])[CH2:41][CH3:42])[s:14]1

Participants

9

Reactant 8

HCID 260Hydrogen BromideHCID 769Bicarbonate IonHCID 813Potassium CationHCID 962WaterHCID 6342AcetonitrileHCID 8857Ethyl AcetateHCID 706082-Bromo-N,N-diethylethanamineHCID 74079973HCID 74079973, compound

Product 1

HCID 75230970HCID 75230970, compound

Sources & evidence

ORD record
ord-2ff9bb73940c4e7c9adf26d8578ca352
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

Loading…