Acetic Acid → HCID 18923982, compound

HRID 167686Notes

Reaction equation

HRID 167686 reaction equation
[C:38]([O:39][CH2:40][CH3:41])(=[O:42])[CH3:43].[CH3:1][O:2][c:3]1[cH:4][cH:5][c:6]([CH2:7][S:10][CH:11]2[CH2:12][CH:13]([CH2:18][OH:19])[S:14](=[O:16])(=[O:17])[CH2:15]2)[cH:8][cH:9]1.[CH3:20][O:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][CH2:33][CH2:34][CH2:35][CH2:36][CH3:37]>>[SH:10][CH:11]1[CH2:12][CH:13]([CH2:18][OH:19])[S:14](=[O:16])(=[O:17])[CH2:15]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 7519AnisoleHCID 8058HexaneHCID 8857Ethyl AcetateHCID 67707349HCID 67707349, compound

Product 1

HCID 18923982HCID 18923982, compound

Sources & evidence

ORD record
ord-bc56922f87364e39b071d8ab7eacb69b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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