Octane → HCID 49840164, compound

HRID 1152338Notes

Reaction equation

HRID 1152338 reaction equation
[CH3:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH3:45].[Cl:34][CH2:35][Cl:36].[OH2:37].[S:1](=[O:2])(=[O:3])([OH:4])[OH:5].[s:6]1[c:7](-[c:29]2[s:30][cH:31][cH:32][cH:33]2)[c:8]([C:11]([CH2:12][CH:13]([CH2:14][CH2:15][CH2:16][CH3:17])[CH2:18][CH3:19])([CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])[OH:28])[cH:9][cH:10]1>>[s:6]1[c:7]2[c:8]([cH:9][cH:10]1)[C:11]([CH2:12][CH:13]([CH2:14][CH2:15][CH2:16][CH3:17])[CH2:18][CH3:19])([CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH3:27])[c:33]1[c:29]-2[s:30][cH:31][cH:32]1

Participants

6

Reactant 5

HCID 356OctaneHCID 962WaterHCID 1118Sulfuric AcidHCID 6344DichloromethaneHCID 49840163HCID 49840163, compound

Product 1

HCID 49840164HCID 49840164, compound

Sources & evidence

ORD record
ord-ba2706504e3f4546b05334b348526a1b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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