Water → Hydrochloric Acid

HRID 137737Notes

Reaction equation

HRID 137737 reaction equation
[CH2:42]1[O:43][CH2:44][CH2:45][CH2:46]1.[CH3:34][CH2:35][N:36]([CH2:37][CH3:38])[CH2:39][CH3:40].[CH:28]1([C:31](=[O:32])[Cl:33])[CH2:29][CH2:30]1.[NH2:1][c:2]1[cH:3][c:4](-[c:8]2[cH:9][cH:10][cH:11][c:12]3[cH:13][c:14]([C:17](=[O:18])[NH:19][CH:20]4[CH2:21][N:22]5[CH2:23][CH2:24][CH:25]4[CH2:26][CH2:27]5)[o:15][c:16]23)[cH:5][cH:6][cH:7]1.[OH2:41]>>[ClH:33].[NH:1]([c:2]1[cH:3][c:4](-[c:8]2[cH:9][cH:10][cH:11][c:12]3[cH:13][c:14]([C:17](=[O:18])[NH:19][CH:20]4[CH2:21][N:22]5[CH2:23][CH2:24][CH:25]4[CH2:26][CH2:27]5)[o:15][c:16]23)[cH:5][cH:6][cH:7]1)[C:31]([CH:28]1[CH2:29][CH2:30]1)=[O:32]

Participants

7

Reactant 5

HCID 962WaterHCID 8028TetrahydrofuranHCID 8471TriethylamineHCID 77637Cyclopropanecarbonyl chlorideHCID 72388825HCID 72388825, compound

Product 2

HCID 313Hydrochloric AcidHCID 17982779HCID 17982779, compound

Sources & evidence

ORD record
ord-56c5c39520b14e03bfdaa53e3caeeca6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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