Hydrochloric Acid → HCID 22710936, compound

HRID 315445Notes

Reaction equation

HRID 315445 reaction equation
[B:49]([Br:50])([Br:51])[Br:52].[CH3:53][OH:54].[Cl:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([S:13](=[O:14])(=[O:15])[N:16]3[CH2:17][CH:18]([C:34]([NH:35][CH2:36][c:37]4[c:38]([O:43][CH3:44])[cH:39][cH:40][cH:41][cH:42]4)=[O:45])[N:19]([C:22](=[O:23])[c:24]4[s:25][c:26]5[c:31]([n:32]4)[CH2:30][CH:29]([CH3:33])[NH:28][CH2:27]5)[CH2:20][CH2:21]3)[cH:9][c:10]2[cH:11][cH:12]1.[Cl:46][CH2:47][Cl:48].[Cl:61][CH2:62][Cl:63].[ClH:1].[Na+:55].[Na+:56].[O-:57][C:58](=[O:59])[O-:60].[OH2:64]>>[Cl:2][c:3]1[cH:4][c:5]2[cH:6][cH:7][c:8]([S:13](=[O:14])(=[O:15])[N:16]3[CH2:17][CH:18]([C:34]([NH:35][CH2:36][c:37]4[c:38]([OH:43])[cH:39][cH:40][cH:41][cH:42]4)=[O:45])[N:19]([C:22](=[O:23])[c:24]4[s:25][c:26]5[c:31]([n:32]4)[CH2:30][CH:29]([CH3:33])[NH:28][CH2:27]5)[CH2:20][CH2:21]3)[cH:9][c:10]2[cH:11][cH:12]1

Participants

9

Reactant 8

HCID 313Hydrochloric AcidHCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 6344Dichloromethane2×HCID 19660Carbonate IonHCID 25134Boron tribromideHCID 22709921HCID 22709921, compound

Product 1

HCID 22710936HCID 22710936, compound

Sources & evidence

ORD record
ord-1f132dcb5c5145d6b04b9ff1418fa965
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

Loading…