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Acetone → HCID 20437378, compound

HRID 2124895
Notes
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Reaction equation

HRID 2124895 reaction equation
[CH2:16]([CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[NH:32][c:33]1[cH:34][cH:35][c:36]([C:37](=[O:38])[OH:39])[cH:40][cH:41]1.[CH2:58]([Cl:59])[Cl:60].[CH2:61]([CH2:62][O:63][CH3:64])[O:65][CH3:66].[CH3:48][C:49](=[O:50])[CH3:51].[CH3:52][CH2:53][O:54][C:55](=[O:56])[CH3:57].[CH3:67][C:68]([N:69]([CH3:70])[CH3:71])=[O:72].[Cl-:47].[H-:14].[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[NH2:13])[cH:8][cH:9]1.[Na+:15].[Na+:46].[OH2:73].[S:42]([Cl:43])([Cl:44])=[O:45]>>[N+:1](=[O:2])([O-:3])[c:4]1[cH:5][cH:6][c:7]([S:10](=[O:11])(=[O:12])[NH:13][C:37]([c:36]2[cH:35][cH:34][c:33]([NH:32][CH2:16][CH2:17][CH2:18][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH3:31])[cH:41][cH:40]2)=[O:38])[cH:8][cH:9]1
ParticipantsSources & evidenceReaction notes

Participants

13

Reactant 12

HCID 180AcetoneHCID 312ChlorideHCID 923Sodium Ion2×HCID 962WaterHCID 6344DichloromethaneHCID 80711,2-DimethoxyethaneHCID 8857Ethyl Acetate
HCID 22784
4-Nitrobenzenesulfonamide
HCID 24386Thionyl Chloride
HCID 31374Dimethylacetamide
HCID 472634-(Hexadecylamino)benzoic acid
HCID 166653Hydride

Product 1

HCID 20437378HCID 20437378, compound

Sources & evidence

ORD record
ord-852f077364114eb4952d55c5e365c3ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

Reaction notes

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On this pageParticipantsSources & evidenceReaction notes