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Chloride → Cyclopentyl 3-cyclopentyloxy-4-(methylthio)benzoate

HRID 160152
Notes
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Reaction equation

HRID 160152 reaction equation
[CH3:1][S-:2].[CH3:29][N:30]1[CH2:31][CH2:32][N:33]([CH3:34])[C:35]1=[O:36].[CH:4]1([O:9][c:10]2[cH:11][c:12]([C:13](=[O:14])[O:15][CH:16]3[CH2:17][CH2:18][CH2:19][CH2:20]3)[cH:21][cH:22][c:23]2[N+:24]([O-:25])=[O:26])[CH2:5][CH2:6][CH2:7][CH2:8]1.[Cl-:28].[Na+:27].[Na+:3].[OH2:37]>>[CH3:1][S:2][c:23]1[c:10]([O:9][CH:4]2[CH2:5][CH2:6][CH2:7][CH2:8]2)[cH:11][c:12]([C:13](=[O:14])[O:15][CH:16]2[CH2:17][CH2:18][CH2:19][CH2:20]2)[cH:21][cH:22]1
ParticipantsSources & evidenceReaction notes

Participants

7

Reactant 6

HCID 312ChlorideHCID 923Sodium Ion2×HCID 962WaterHCID 66611,3-Dimethyl-2-imidazolidinoneHCID 519392MercaptomethanideHCID 21187914Cyclopentyl 3-cyclopentyloxy-4-nitrobenzoate

Product 1

HCID 21187855Cyclopentyl 3-cyclopentyloxy-4-(methylthio)benzoate

Sources & evidence

ORD record
ord-2c7c689f0da74002a39d92823519ca83
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes