Phosgene → HCID 13672663, compound

HRID 669778Notes

Reaction equation

HRID 669778 reaction equation
[CH2:16]([N:17]=[C:21]=[O:22])[CH2:18][CH2:19][CH3:20].[CH2:23]1[N:24]2[CH2:25][CH2:26][N:27]([CH2:28][CH2:29]2)[CH2:30]1.[CH3:1][C:2]1([CH3:15])[CH2:3][c:4]2[c:5]([c:7]([S:11](=[O:12])(=[O:13])[NH2:14])[cH:8][cH:9][cH:10]2)[S:6]1.[Cl:31][C:32](=[O:33])[Cl:34]>>[CH3:1][C:2]1([CH3:15])[CH2:3][c:4]2[c:5]([c:7]([S:11](=[O:12])(=[O:13])[N:14]=[C:21]=[O:22])[cH:8][cH:9][cH:10]2)[S:6]1

Participants

5

Reactant 4

HCID 6371PhosgeneHCID 8110Butyl isocyanateHCID 9237DabcoHCID 13424189HCID 13424189, compound

Product 1

HCID 13672663HCID 13672663, compound

Sources & evidence

ORD record
ord-46f04d06e478456e90e2e09add98f03d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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