Acetic Acid → HCID 22272615, compound

HRID 700007Notes

Reaction equation

HRID 700007 reaction equation
[CH2:14]1[N:15]2[CH2:16][N:17]3[CH2:18][N:19]([CH2:20]2)[CH2:21][N:22]1[CH2:23]3.[CH3:24][C:25]([OH:26])=[O:27].[CH:1]([CH3:2])([CH3:3])[c:4]1[c:5]([NH2:6])[c:7]([CH:11]([CH3:12])[CH3:13])[cH:8][cH:9][cH:10]1.[OH2:28]>>[CH:1]([CH3:2])([CH3:3])[c:4]1[c:5]([NH2:6])[c:7]([CH:11]([CH3:12])[CH3:13])[cH:8][c:9]([CH:25]=[O:26])[cH:10]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 962WaterHCID 4101HexamethylenetetramineHCID 32484Diisopropylaniline

Product 1

HCID 22272615HCID 22272615, compound

Sources & evidence

ORD record
ord-32ce38d265314059b7f25de3dcd217fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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