1-Butanol → Hydrochloric Acid

HRID 1145808Notes

Reaction equation

HRID 1145808 reaction equation
[C:22](=[O:23])([O-:24])[O-:25].[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]([c:10]1[c:11]([C:12](=[O:13])[NH2:14])[cH:15][cH:16][cH:17][cH:18]1)[CH2:19][CH2:20][Cl:21].[CH2:41]([OH:42])[CH2:43][CH2:44][CH3:45].[CH:46]([Cl:47])([Cl:48])[Cl:49].[ClH:1].[Na+:26].[Na+:27].[OH:28][C:29]1([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[CH2:30][CH2:31][NH:32][CH2:33][CH2:34]1>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:9]([c:10]1[c:11]([C:12](=[O:13])[NH2:14])[cH:15][cH:16][cH:17][cH:18]1)[CH2:19][CH2:20][N:32]1[CH2:31][CH2:30][C:29]([OH:28])([c:35]2[cH:36][cH:37][cH:38][cH:39][cH:40]2)[CH2:34][CH2:33]1.[ClH:21]

Participants

9

Reactant 7

HCID 2631-ButanolHCID 313Hydrochloric AcidHCID 923Sodium ion2×HCID 6212ChloroformHCID 19660Carbonate IonHCID 963874-Phenylpiperidin-4-olHCID 20338243HCID 20338243, compound

Product 2

HCID 313Hydrochloric AcidHCID 3050168HCID 3050168, compound

Sources & evidence

ORD record
ord-395fdd5490924ab4b2a3ed8bdb97d44e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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