1,3-Propanediamine, N1,N1,N3-trimethyl- → HCID 67385279, compound

HRID 170808Notes

Reaction equation

HRID 170808 reaction equation
[CH3:48][N:49]([CH2:50][CH2:51][CH2:52][NH:53][CH3:54])[CH3:55].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][c:11]3[c:12]2[n:13][c:14]([N:42]2[CH2:43][CH2:44][O:45][CH2:46][CH2:47]2)[n:15][c:16]3-[c:17]2[cH:18][n:19][c:20]([N:23]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]3)[CH2:33][c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[n:21][cH:22]2)[cH:6][n:7]1>>[c:2]1([N:53]([CH2:52][CH2:51][CH2:50][N:49]([CH3:48])[CH3:55])[CH3:54])[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH2:10][c:11]3[c:12]2[n:13][c:14]([N:42]2[CH2:43][CH2:44][O:45][CH2:46][CH2:47]2)[n:15][c:16]3-[c:17]2[cH:18][n:19][c:20]([N:23]([CH2:24][c:25]3[cH:26][cH:27][c:28]([O:31][CH3:32])[cH:29][cH:30]3)[CH2:33][c:34]3[cH:35][cH:36][c:37]([O:40][CH3:41])[cH:38][cH:39]3)[n:21][cH:22]2)[cH:6][n:7]1

Participants

3

Reactant 2

HCID 783021,3-Propanediamine, N1,N1,N3-trimethyl-HCID 59244926HCID 59244926, compound

Product 1

HCID 67385279HCID 67385279, compound

Sources & evidence

ORD record
ord-fb636be2fba3435a87c247f66faaec9e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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