Acetic Acid → 1-Carboxy-3-nitro-5-adamantanol

HRID 187674

Reaction equation

HRID 187674 reaction equation
[C:2](=[O:3])([OH:4])[C:5]12[CH2:6][C:7]3([N+:15](=[O:16])[O-:17])[CH2:8][CH:9]([CH2:10][CH:11]([CH2:12]1)[CH2:13]3)[CH2:14]2.[CH3:30][C:31](=[O:32])[OH:33].[O:1].[OH:18][N:19]1[C:20](=[O:21])[c:22]2[cH:23][cH:24][cH:25][cH:26][c:27]2[C:28]1=[O:29]>>[C:2](=[O:3])([OH:4])[C:5]12[CH2:6][C:7]3([N+:15](=[O:16])[O-:17])[CH2:8][C:9]([OH:18])([CH2:10][CH:11]([CH2:12]1)[CH2:13]3)[CH2:14]2

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 10665N-HydroxyphthalimideHCID 392393-Nitrotricyclo(3.3.1.13,7)decane-1-carboxylic acid

Product 1

HCID 224635701-Carboxy-3-nitro-5-adamantanol

Sources & evidence

ORD record
ord-26bc864551b242c3aefdbb2699ec084f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Linked notes

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