Bicarbonate Ion → Hydrochloric Acid

HRID 2341000Notes

Reaction equation

HRID 2341000 reaction equation
[C:35](=[O:36])([OH:37])[O-:38].[CH2:78]([Cl:79])[Cl:80].[CH2:81]([C:82]([CH3:83])=[O:84])[CH3:85].[CH2:86]([O:87][CH2:88][CH3:89])[CH3:90].[Cl:1][c:2]1[cH:3][c:4]([Cl:5])[cH:6][c:7]([Cl:8])[c:9]1[S:10]([N:11]([CH2:12][CH2:13][O:14][CH2:15][C:16]([OH:17])=[O:18])[CH3:19])(=[O:20])=[O:21].[Cl:40][c:41]1[c:42]([S:49](=[O:50])(=[O:51])[N:52]([CH3:53])[CH2:54][CH2:55][O:56][CH2:57][C:58](=[O:59])[N:60]2[CH2:61][CH2:62][C:63]([c:66]3[cH:67][n:68][cH:69][cH:70][cH:71]3)([OH:72])[CH2:64][CH2:65]2)[c:43]([Cl:48])[cH:44][c:45]([Cl:47])[cH:46]1.[Cl:73][Si:74]([CH3:75])([CH3:76])[CH3:77].[Na+:39].[n:22]1[cH:23][cH:24][cH:25][c:26]([C:27]2([OH:28])[CH2:29][CH2:30][NH:31][CH2:32][CH2:33]2)[cH:34]1>>[Cl:40][c:41]1[c:42]([S:49](=[O:50])(=[O:51])[N:52]([CH3:53])[CH2:54][CH2:55][O:56][CH2:57][C:58](=[O:59])[N:60]2[CH2:61][CH2:62][C:63]([c:66]3[cH:67][n:68][cH:69][cH:70][cH:71]3)([OH:72])[CH2:64][CH2:65]2)[c:43]([Cl:48])[cH:44][c:45]([Cl:47])[cH:46]1.[ClH:1]

Participants

11

Reactant 9

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6397ChlorotrimethylsilaneHCID 6569Methyl Ethyl KetoneHCID 49891674-(Pyridin-3-yl)piperidin-4-olHCID 250085762,4,6-Trichloro-N-(2-(2-(4-hydroxy-4-(pyridin-3-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-N-methylphenylsulfonamideHCID 579042242-(2-(2,4,6-trichloro-N-methylphenylsulfonamido)ethoxy)acetic acid

Product 2

HCID 313Hydrochloric AcidHCID 250085762,4,6-Trichloro-N-(2-(2-(4-hydroxy-4-(pyridin-3-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-N-methylphenylsulfonamide

Sources & evidence

ORD record
ord-128d517ae96748bb9b7287843abe57ee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

Loading…