Acetate → HCID 13280950, compound

HRID 1229309Notes

Reaction equation

HRID 1229309 reaction equation
[C:31]([O-:32])(=[O:33])[CH3:34].[C:35]([O-:36])(=[O:37])[CH3:38].[C:39]([O-:40])(=[O:41])[CH3:42].[C:43]([O-:44])(=[O:45])[CH3:46].[C:48](=[O:49])([OH:50])[O-:51].[CH2:53]([Cl:54])[Cl:55].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:22][cH:23]1)[C:6]1=[C:7]([CH2:8][N:9]=[C:10]2[c:11]2[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]2)[C:18](=[O:21])[NH:19][CH2:20]1.[Na+:52].[OH:24][C:25]([C:26]([Cl:27])([Cl:28])[Cl:29])=[O:30].[Pb+4:47]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:22][cH:23]1)[C:6]1=[C:7]([CH2:8][N:9]=[C:10]2[c:11]2[c:12]([Cl:17])[cH:13][cH:14][cH:15][cH:16]2)[C:18](=[O:21])[NH:19][CH:20]1[OH:24]

Participants

8

Reactant 7

HCID 175Acetate4×HCID 769Bicarbonate IonHCID 923Sodium ionHCID 6344DichloromethaneHCID 6421Trichloroacetic AcidHCID 145981Ro 22-8515HCID 178527690HCID 178527690, compound

Product 1

HCID 13280950HCID 13280950, compound

Sources & evidence

ORD record
ord-ba18416c2f1446dc838c213709cc64a7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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