Chloride → Ethyl 2-(4-n-octylbenzoyl)cyclopropane carboxylate

HRID 97162

Reaction equation

HRID 97162 reaction equation
[Al+3:2].[CH2:32]([Cl:33])[Cl:34].[CH2:6]([CH3:7])[O:8][C:9](=[O:10])[CH:11]1[CH:12]([C:14](=[O:15])[OH:16])[CH2:13]1.[Cl-:1].[Cl-:3].[Cl-:4].[Cl-:5].[ClH:31].[OH2:35].[c:17]1([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[CH2:6]([CH3:7])[O:8][C:9](=[O:10])[CH:11]1[CH:12]([C:14](=[O:16])[c:20]2[cH:19][cH:18][c:17]([CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH3:30])[cH:22][cH:21]2)[CH2:13]1

Participants

8

Reactant 7

HCID 312Chloride4×HCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 16607OctylbenzeneHCID 104727Aluminum CationHCID 3174452-(Ethoxycarbonyl)cyclopropane-1-carboxylic acid

Product 1

HCID 22420396Ethyl 2-(4-n-octylbenzoyl)cyclopropane carboxylate

Sources & evidence

ORD record
ord-0941e2ebe6ae45cd8b8f2a729783b04c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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