Homarylamine

Base Information Edit

Chemical Name:Homarylamine
CAS No.:451-77-4
Molecular Formula:C10H13 N O2
Molecular Weight:179.219
Hs Code.:2932999099
UNII:6FJ4B5B368
DSSTox Substance ID:DTXSID90196385
Nikkaji Number:J5.753C
Wikipedia:Homarylamine
Wikidata:Q6823985
NCI Thesaurus Code:C65856
ChEMBL ID:CHEMBL2104353
Mol file:451-77-4.mol

Synonyms:Homarylamine;451-77-4;5-[2-(Methylamino)ethyl]-1,3-benzodioxole;Homarylamine [INN];Homarilamina;Homarylaminum;Mdmpea;N-methylhomopiperonylamine;2-(1,3-benzodioxol-5-yl)-N-methylethanamine;Homarylaminum [INN-Latin];Homarilamina [INN-Spanish];Mk-71;UNII-6FJ4B5B368;6FJ4B5B368;N-Methyl-1,3-benzodioxol-5-ethylamin;N-Methyl-3,4-methylenedioxyphenethylamine;[2-(2H-1,3-benzodioxol-5-yl)ethyl](methyl)amine;N-Methyl-3,4-(methylenedioxy)phenethylamine;3,4-(Methylenedioxy)-N-methyl-beta-phenethylamine;1,3-Benzodioxole-5-ethanamine, N-methyl-;N-Methylhomopiperonylamin;SCHEMBL1237889;CHEMBL2104353;DTXSID90196385;HOMARYLAMINE [NFLIS-DRUG];CHEBI:134816;AC6162;MFCD00868863;AKOS006240982;SY026811;CS-0452617;[2-(1,3-dioxaindan-5-yl)ethyl](methyl)amine;EN300-386288;A919100;Q6823985;2-(Benzo[d][1,3]dioxol-5-yl)-N-methylethan-1-amine;F1911-1816

Suppliers and Price of Homarylamine

Supply Marketing:Edit

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

Chemenu
5-[2-(Methylamino)ethyl]-1,3-benzodioxole 95%
1g
$ 474.00

American Custom Chemicals Corporation
HOMARYLAMINE 95.00%
5MG
$ 503.42

AK Scientific
Homarylamine
1g
$ 937.00

Total 4 raw suppliers

Chemical Property of Homarylamine Edit

Chemical Property:

Vapor Pressure:0.00556mmHg at 25°C
Boiling Point:274°Cat760mmHg
Flash Point:106.8°C
PSA：30.49000
Density:1.128g/cm³
LogP:1.56810
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:179.094628657
Heavy Atom Count:13
Complexity:163

Purity/Quality:

99%, ^*data from raw suppliers

5-[2-(Methylamino)ethyl]-1,3-benzodioxole 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNCCC1=CC2=C(C=C1)OCO2
Uses Used in the synthesis of Optically Pure (S)-Scoulerine and Berbine and Benzylisoquinoline Alkaloids

Technology Process of Homarylamine

There total 12 articles about Homarylamine 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: 97.0%

: 62529-64-0
2-(benzo[d][1,3]dioxol-5-yl)ethyl methanesulfonate

: 74-89-5
methylamine

: 451-77-4
2-(benzo[d][1,3]dioxol-5-yl)-N-methylethan-1-amine

Guidance literature:: 2-(benzo[d][1,3]dioxol-5-yl)ethyl methanesulfonate; methylamine; In methanol; water; at 140 ℃; for 0.166667h; under 15514.9 Torr; Flow reactor;

With potassium hydroxide; In water;
DOI:10.1021/acs.oprd.0c00193

Reference yield: 82.0%

: 33542-98-2
β-<3,4-(methylenedioxy)phenyl>ethyl formamide

: 451-77-4
2-(benzo[d][1,3]dioxol-5-yl)-N-methylethan-1-amine

Guidance literature:: With lithium aluminium tetrahydride; In tetrahydrofuran; for 4h; Heating;
DOI:10.1021/jo060612n

Reference yield: 80.0%

: 127901-41-1
(3,4-methylenedioxy)phenyl-N-methylacetamide

: 451-77-4
2-(benzo[d][1,3]dioxol-5-yl)-N-methylethan-1-amine

Guidance literature:: With lithium aluminium tetrahydride; aluminium trichloride; In tetrahydrofuran; diethyl ether; for 15h; Ambient temperature;
DOI:10.1248/cpb.37.3396