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3036581-87-7

3036581-87-7 Structure

3036581-87-7 Structure
IdentificationBack Directory
[Name]

Propafenone Impurity 48 (N-Nitroso Propafenone)
[CAS]

3036581-87-7
[Synonyms]

N-nitrosopropene
Propafenone Impurity 20
N-nitrosopropoxypropanone
Propafenone Impurity 48 (N-Nitroso Propafenone)
N-(2-hydroxy-3-(2-(3-phenylpropanoyl)phenoxy)propyl)-N-propylnitrous amide
1-Propanone, 1-[2-[2-hydroxy-3-(nitrosopropylamino)propoxy]phenyl]-3-phenyl-
[Molecular Formula]

C21H26N2O4
[MOL File]

3036581-87-7.mol
[Molecular Weight]

370.44
Chemical PropertiesBack Directory
[Boiling point ]

592.1±50.0 °C(predicted)
[density ]

1.13±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)
[pka]

13.14±0.20(predicted)
[InChI]

InChI=1S/C21H26N2O4/c1-2-14-23(22-26)15-18(24)16-27-21-11-7-6-10-19(21)20(25)13-12-17-8-4-3-5-9-17/h3-11,18,24H,2,12-16H2,1H3
[InChIKey]

IHEULQLSOWGDOG-UHFFFAOYSA-N
[SMILES]

O(C1C=CC=CC=1C(=O)CCC1C=CC=CC=1)CC(O)CN(N=O)CCC
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