Adiphenine methyl bromide

Base Information

Chemical Name:Adiphenine methyl bromide
CAS No.:6113-04-8
Molecular Formula:C21H28NO2+
Molecular Weight:406.363
Hs Code.:2923900090
European Community (EC) Number:228-077-8
NSC Number:83044
UNII:2OVU84VI37
DSSTox Substance ID:DTXSID10976646
Wikidata:Q27255269
Pharos Ligand ID:1K1TS76G4YTA
ChEMBL ID:CHEMBL2377385
Mol file:6113-04-8.mol

Synonyms:Adiphenine methyl bromide;Remitan;Lunal;6113-04-8;2OVU84VI37;CHEMBL2377385;Diphenylacetic acid 2-(diethylamino)ethyl ester methyl bromide;Ammonium, diethyl(2-hydroxyethyl)methyl-, bromide, diphenylacetate;2-Diethylaminoethyl diphenylacetate methyl bromide;EINECS 228-077-8;NSC 83044;NSC-83044;Acetic acid, diphenyl-, ester with diethyl(2-hydroxyethyl)methylammonium bromide;(2-(Diphenylacetoxy)ethyl)diethylmethylammonium bromide;Ethanaminium, 2-((diphenylacetyl)oxy)-N,N-diethyl-N-methyl-, bromide;UNII-2OVU84VI37;ADIPHENINE METHOBROMIDE;DTXSID10976646;Ammonium, bromide, diphenylacetate;NSC83044;BDBM50491121;AKOS024429279;LS-17411;Q27255269;2-(2,2-diphenylacetyl)oxyethyl-diethyl-methylazanium;bromide;2-[(Diphenylacetyl)oxy]-N,N-diethyl-N-methylethan-1-aminium bromide;Acetic acid, ester with diethyl(2-hydroxyethyl)methylammonium bromide;ETHANAMINIUM, 2-((2,2-DIPHENYLACETYL)OXY)-N,N-DIETHYL-N-METHYL-, BROMIDE (1:1)

Suppliers and Price of Adiphenine methyl bromide

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Sigma-Aldrich
DIETHYL(2-(DIPHENYLACETOXY)-ETHYL)METHYLAMMONIUM BROMIDE AldrichCPR
100mg
$ 144.00

Total 6 raw suppliers

Chemical Property of Adiphenine methyl bromide

Chemical Property:

Boiling Point:423°Cat760mmHg
Flash Point:133.2°C
PSA：26.30000
Density:g/cm³
LogP:0.85210
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:9
Exact Mass:405.13034
Heavy Atom Count:25
Complexity:348

Purity/Quality:

98%,99%, ^*data from raw suppliers

DIETHYL(2-(DIPHENYLACETOXY)-ETHYL)METHYLAMMONIUM BROMIDE AldrichCPR ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC[N+](C)(CC)CCOC(=O)C(C1=CC=CC=C1)C2=CC=CC=C2.[Br-]

Technology Process of Adiphenine methyl bromide

There total 3 articles about Adiphenine methyl bromide 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:

: 74-83-9
methyl bromide

: 64-95-9
adiphenine

: 6113-04-8
diethyl-(2-diphenylacetoxy-ethyl)-methyl-ammonium; bromide

Guidance literature:: DOI:10.1021/jo50006a015

Reference yield:

: 41165-37-1
diphenyl-acetic acid-(2-bromo-ethyl ester)

: 616-39-7
N,N-diethylnmethylamine

: 6113-04-8
diethyl-(2-diphenylacetoxy-ethyl)-methyl-ammonium; bromide

Guidance literature:: With acetone; at 100 ℃;

Reference yield:

: 117-34-0
2,2-diphenylacetic acid

: 6113-04-8
diethyl-(2-diphenylacetoxy-ethyl)-methyl-ammonium; bromide

Guidance literature:: Multi-step reaction with 2 steps

1: H₂SO₄; CCl₄

2: acetone / 100 °C

With tetrachloromethane; sulfuric acid; acetone;