Bicarbonate Ion → Hydrochloric Acid

HRID 2153351Notes

Reaction equation

HRID 2153351 reaction equation
[C:36](=[O:37])([OH:38])[O-:39].[CH2:80]([Cl:81])[Cl:82].[CH2:83]([C:84]([CH3:85])=[O:86])[CH3:87].[CH2:88]([O:89][CH2:90][CH3:91])[CH3:92].[CH3:1][O:2][c:3]1[cH:4][c:5]([CH3:6])[c:7]([S:8]([N:9]([CH2:10][CH2:11][O:12][CH2:13][C:14]([OH:15])=[O:16])[CH3:17])(=[O:18])=[O:19])[c:20]([CH3:21])[cH:22]1.[Cl:75][Si:76]([CH3:77])([CH3:78])[CH3:79].[Na+:40].[OH:41][C:42]1([c:69]2[cH:70][n:71][cH:72][cH:73][cH:74]2)[CH2:43][CH2:44][N:45]([C:48]([CH2:49][O:50][CH2:51][CH2:52][N:53]([S:54](=[O:55])(=[O:56])[c:57]2[c:58]([CH3:66])[cH:59][c:60]([O:64][CH3:65])[cH:61][c:62]2[CH3:63])[CH3:67])=[O:68])[CH2:46][CH2:47]1.[n:23]1[cH:24][cH:25][cH:26][c:27]([C:28]2([OH:29])[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]2)[cH:35]1>>[ClH:75].[OH:41][C:42]1([c:69]2[cH:70][n:71][cH:72][cH:73][cH:74]2)[CH2:43][CH2:44][N:45]([C:48]([CH2:49][O:50][CH2:51][CH2:52][N:53]([S:54](=[O:55])(=[O:56])[c:57]2[c:58]([CH3:66])[cH:59][c:60]([O:64][CH3:65])[cH:61][c:62]2[CH3:63])[CH3:67])=[O:68])[CH2:46][CH2:47]1

Participants

11

Reactant 9

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 3283Diethyl EtherHCID 6344DichloromethaneHCID 6397ChlorotrimethylsilaneHCID 6569Methyl Ethyl KetoneHCID 49891674-(Pyridin-3-yl)piperidin-4-olHCID 25008578N-(2-(2-(4-Hydroxy-4-(pyridin-3-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-4-methoxy-N,2,6-trimethylphenylsulfonamideHCID 46870354{2-[(4-methoxy-2,6-dimethyl-benzenesulfonyl)-methyl-amino]-ethoxy}acetic Acid

Product 2

HCID 313Hydrochloric AcidHCID 25008578N-(2-(2-(4-Hydroxy-4-(pyridin-3-yl)piperidin-1-yl)-2-oxoethoxy)ethyl)-4-methoxy-N,2,6-trimethylphenylsulfonamide

Sources & evidence

ORD record
ord-0d4cc06816a24fb9834ec661c217aa1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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