Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-

Base Information

Chemical Name:Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-
CAS No.:290301-40-5
Molecular Formula:C16H20BrNO
Molecular Weight:322.245
Hs Code.:
DSSTox Substance ID:DTXSID60473877
Nikkaji Number:J1.420.306K
Wikidata:Q82303551
Mol file:290301-40-5.mol

Synonyms:290301-40-5;Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-;DTXSID60473877

Suppliers and Price of Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-

Supply Marketing:

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

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Chemical Property of Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-

Chemical Property:

XLogP3:3.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:321.07283
Heavy Atom Count:19
Complexity:313

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C=C(CN(CC1=CC=CC=C1)C2CCC(=O)CC2)Br

Technology Process of Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]-

There total 2 articles about Cyclohexanone, 4-[(2-bromo-2-propenyl)(phenylmethyl)amino]- 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: 88.0%

: 4-[N-benzyl-N-(2-bromoallyl)amino]cyclohexanone ethylene acetal

: 290301-40-5
4-[N-benzyl-N-(2-bromoallyl)amino]cyclohexanone

Guidance literature:: With hydrogenchloride; In tetrahydrofuran; water; at 20 ℃; for 16h;
DOI:10.1021/jo034299q

Reference yield:

: 131511-13-2
4-(N-benzylamino)cyclohexanone ethylene acetal

: 290301-40-5
4-[N-benzyl-N-(2-bromoallyl)amino]cyclohexanone

Guidance literature:: Multi-step reaction with 2 steps

1: 93 percent / K₂CO₃; LiI / acetonitrile / 20 - 55 °C

2: 88 percent / HCl / tetrahydrofuran; H₂O / 16 h / 20 °C

With hydrogenchloride; potassium carbonate; lithium iodide; In tetrahydrofuran; water; acetonitrile;
DOI:10.1021/jo034299q

Reference yield: 92.0%

: 290301-40-5
4-[N-benzyl-N-(2-bromoallyl)amino]cyclohexanone

: 2-benzyl-4-methylene-2-azabicyclo[3.3.1]nonan-6-one

Guidance literature:: With potassium tert-butylate; phenol; tetrakis(triphenylphosphine) palladium⁽⁰⁾; In tetrahydrofuran; tert-butyl alcohol; for 3h; Heating;
DOI:10.1002/adsc.200404148