Potassium caroate → HCID 178521027, compound

HRID 2029700Notes

Reaction equation

HRID 2029700 reaction equation
[Cl:1][c:2]1[cH:6][n:5]([C:7]2([c:10]3[nH:18][c:17]([c:12]4[n:11]3)[n:16][c:15]([N:19]5[CH2:24][C@H:23]([C:25]([N:27]6[CH2:31][CH2:30][CH2:29][CH2:28]6)=[O:26])[CH2:22][CH2:21][CH2:20]5)[cH:14][cH:13]4)[CH2:9][CH2:8]2)[n:4][cH:3]1.[K+].[K+].[K+].[K+].[K+].[OH:32]S([O-])(=O)=O.OS(O[O-])(=O)=O.OS(O[O-])(=O)=O.[O-]S([O-])(=O)=O>>[OH:32][c:13]1[c:12]([c:17]2[n:16][c:15]([N:19]3[CH2:24][C@H:23]([C:25]([N:27]4[CH2:31][CH2:30][CH2:29][CH2:28]4)=[O:26])[CH2:22][CH2:21][CH2:20]3)[cH:14]1)[n:11][c:10]([C:7]5([n:5]6[n:4][cH:3][c:2]([Cl:1])[cH:6]6)[CH2:9][CH2:8]5)[nH:18]2

Participants

7

Reactant 2

HCID 15793144Potassium caroateHCID 178521019HCID 178521019, compound

Product 1

HCID 178521027HCID 178521027, compound

Reagents, catalysts & solvents 4

HCID 178478092HCID 178478092, compoundCatalystHCID 111,2-DichloroethaneSolventHCID 6342AcetonitrileSolventHCID 117669-PhenylanthraceneInternal standard

Conditions

Temperature
25 °C

Sources & evidence

ORD record
ord-c142a588ec6546d7b268fc3b4cd26a64
Source dataset
39k HTE dataset from Pfizer
Original link
View source

Reaction notes

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