Hydrochloric Acid → Hydrochloric Acid

HRID 157028Notes

Reaction equation

HRID 157028 reaction equation
[BH4-:30].[CH3:26][OH:27].[CH3:28][NH2:29].[CH3:38][OH:39].[ClH:32].[F:1][c:2]1[c:3](-[c:8]2[n:9]([S:15](=[O:16])(=[O:17])[c:18]3[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]3)[cH:10][c:11]([CH:13]=[O:14])[cH:12]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:31].[Na+:33].[OH:34][C:35](=[O:36])[O-:37]>>[ClH:32].[F:1][c:2]1[c:3](-[c:8]2[n:9]([S:15](=[O:16])(=[O:17])[c:18]3[cH:19][cH:20][c:21]([C:22]#[N:23])[cH:24][cH:25]3)[cH:10][c:11]([CH2:13][NH:29][CH3:28])[cH:12]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

9

Reactant 7

HCID 313Hydrochloric AcidHCID 769Bicarbonate IonHCID 887Methanol2×HCID 923Sodium ion2×HCID 6329MethylamineHCID 28123BorohydrideHCID 86620784HCID 86620784, compound

Product 2

HCID 313Hydrochloric AcidHCID 66925046HCID 66925046, compound

Sources & evidence

ORD record
ord-b327c7a4f1af49ba83382d7447107dc4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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