Hydrochloric Acid → (1-Nitromethylcyclohexyl)acetic acid ethyl ester

HRID 1230837Notes

Reaction equation

HRID 1230837 reaction equation
[C:1](=[O:2])([O-:3])[O-:4].[C:7]1(=[CH:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1.[CH3:24][S:25](=[O:26])[CH3:27].[ClH:23].[K+:5].[K+:6].[N+:19](=[O:20])([O-:21])[CH3:22].[OH2:28]>>[C:7]1([CH2:13][C:14](=[O:15])[O:16][CH2:17][CH3:18])([CH2:22][N+:19](=[O:20])[O-:21])[CH2:8][CH2:9][CH2:10][CH2:11][CH2:12]1

Participants

8

Reactant 7

HCID 313Hydrochloric AcidHCID 679Dimethyl SulfoxideHCID 813Potassium Cation2×HCID 962WaterHCID 6375NitromethaneHCID 19660Carbonate IonHCID 73776Ethyl cyclohexylideneacetate

Product 1

HCID 11128083(1-Nitromethylcyclohexyl)acetic acid ethyl ester

Sources & evidence

ORD record
ord-c460a33092b14178be5468cb76ec54f0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

Loading…