Sodium ion → HCID 9855722, compound

HRID 1131971Notes

Reaction equation

HRID 1131971 reaction equation
[CH3:26][CH2:27][O:28][C:29](=[O:30])[CH3:31].[NH2:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7]([Br:10])[cH:8][cH:9]1.[Na+:11].[Na+:12].[O-:13][C:14](=[O:15])[O-:16].[O:32]1[CH2:33][CH2:34][O:35][CH2:36][CH2:37]1.[OH2:38].[c:17]1([B:23]([OH:24])[OH:25])[cH:18][cH:19][cH:20][cH:21][cH:22]1>>[NH2:1][c:2]1[c:3]([C:4]#[N:5])[cH:6][c:7](-[c:17]2[cH:18][cH:19][cH:20][cH:21][cH:22]2)[cH:8][cH:9]1

Participants

8

Reactant 7

HCID 923Sodium ion2×HCID 962WaterHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 66827Phenylboronic AcidHCID 4297402-Amino-5-bromobenzonitrile

Product 1

HCID 9855722HCID 9855722, compound

Sources & evidence

ORD record
ord-7ff26de970044da2becdd61a518f1975
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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