Chloride → 4-(1-Ethylpyrrolo[2,1,5-cd]indolizin-2-yl)phenol

HRID 1540878Notes

Reaction equation

HRID 1540878 reaction equation
[Al+3:23].[C:33]([O:34][CH2:35][CH3:36])(=[O:37])[CH3:38].[CH2:1]([CH3:2])[c:3]1[c:4](-[c:14]2[cH:15][cH:16][c:17]([O:20][CH3:21])[cH:18][cH:19]2)[c:5]2[n:6]3[c:7]([cH:8][cH:9][cH:10][c:11]13)[cH:12][cH:13]2.[CH2:26]([SH:27])[CH3:28].[CH3:46][CH2:47][O:48][C:49](=[O:50])[CH3:51].[Cl-:22].[Cl-:24].[Cl-:25].[Cl:30][CH2:31][Cl:32].[ClH:29].[O:53]1[CH2:54][CH2:55][CH2:56][CH2:57]1.[OH2:52].[c:39]1([CH3:40])[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH2:1]([CH3:2])[c:3]1[c:4](-[c:14]2[cH:15][cH:16][c:17]([OH:20])[cH:18][cH:19]2)[c:5]2[n:6]3[c:7]([cH:8][cH:9][cH:10][c:11]13)[cH:12][cH:13]2

Participants

11

Reactant 10

HCID 312Chloride3×HCID 313Hydrochloric AcidHCID 962WaterHCID 1140TolueneHCID 6343EthanethiolHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 8857Ethyl Acetate2×HCID 104727Aluminum CationHCID 18706925HCID 18706925, compound

Product 1

HCID 99033364-(1-Ethylpyrrolo[2,1,5-cd]indolizin-2-yl)phenol

Sources & evidence

ORD record
ord-f695950fceec4545935342d62c0ae075
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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