(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Base Information

Chemical Name:(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide
CAS No.:1357580-60-9
Molecular Formula:BrH*Br*C₃₁H₃₂ClN₄O₄
Molecular Weight:720.888
Hs Code.:

(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Synonyms:(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of (E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Chemical Property:

Purity/Quality:: 98% ^*data from raw suppliers

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Technology Process of (E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

There total 4 articles about (E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 78.0%

: 1017279-01-4
2-(bromomethyl)-1-methyl-5-nitro-1H-pyrrole

: 1017279-20-7
1-(chloromethyl)-3-[(E)-4-(dimethylaminomethyl)cinnamoyl]-5-hydroxy-1,2-dihydro-3H-benzo[e]indole

: 1357580-60-9
(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Guidance literature:: In tetrahydrofuran; at 20 ℃; for 432h; Darkness;
DOI:10.1016/j.bmc.2011.12.007

Reference yield:

: 1017279-66-1
methyl (E)-4-(dimethylaminomethyl)cinnamate

: 1357580-60-9
(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Guidance literature:: Multi-step reaction with 3 steps

1.1: sodium hydroxide / methanol; water / 2 h / Reflux

1.2: 20 °C

2.1: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

2.2: 16 h / 20 °C

3.1: tetrahydrofuran / 432 h / 20 °C / Darkness

With hydrogenchloride; sodium hydroxide; In tetrahydrofuran; 1,4-dioxane; methanol; water;
DOI:10.1016/j.bmc.2011.12.007

Reference yield:

: 27050-96-0
2-(hydroxymethyl)-1-methyl-5-nitropyrrole

: 1357580-60-9
(E)-N-(4-(3-(1-(chloromethyl)-5-hydroxy-1H-benzo[e]indol-3(2H)-yl)-3-oxoprop-1-enyl)benzyl)-N,N-dimethyl-1-(1-methyl-5-nitro-1H-pyrrol-2-yl)methanaminium bromide hydrobromide

Guidance literature:: Multi-step reaction with 2 steps

1: bromine; triphenylphosphine / acetonitrile / 0.58 h / 20 °C

2: tetrahydrofuran / 432 h / 20 °C / Darkness

With bromine; triphenylphosphine; In tetrahydrofuran; acetonitrile;
DOI:10.1016/j.bmc.2011.12.007