Calcium Cation → 2-Chlorotetradecanoic acid

HRID 138166

Reaction equation

HRID 138166 reaction equation
[Br:1][CH:2]([C:3](=[O:4])[OH:5])[CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH3:17].[CH2:32]([N+:33]([CH2:34][CH3:35])([CH2:36][CH3:37])[CH2:38][CH3:39])[CH3:40].[CH3:21][CH2:22][N:23]([CH2:24][CH3:25])[CH2:26][CH3:27].[CH3:28][C:29]#[N:30].[Ca+2:20].[Cl-:18].[Cl-:19].[Cl-:31]>>[CH:2]([C:3](=[O:4])[OH:5])([CH2:6][CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][CH2:12][CH2:13][CH2:14][CH2:15][CH2:16][CH3:17])[Cl:18]

Participants

7

Reactant 6

HCID 271Calcium CationHCID 312Chloride3×HCID 5413TetraethylammoniumHCID 6342AcetonitrileHCID 8471TriethylamineHCID 663402-Bromomyristic acid

Product 1

HCID 124537492-Chlorotetradecanoic acid

Sources & evidence

ORD record
ord-e2eeed16c58046dc887bffb254a8673a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Linked notes

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