N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine

Base Information

Chemical Name:N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine
CAS No.:68291-92-9
Molecular Formula:C11H15NO2
Molecular Weight:193.2423
Hs Code.:
NSC Number:131714
DSSTox Substance ID:DTXSID90299643
Wikidata:Q82042140
Mol file:68291-92-9.mol

Synonyms:68291-92-9;N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine;N-(benzo[1,3]dioxol-5-ylmethyl)propan-2-amine;N-(Benzo[d][1,3]dioxol-5-ylmethyl)propan-2-amine;AKOS B023217;NSC131714;Oprea1_091698;Oprea1_486352;(1,3-BENZODIOXOL-5-YLMETHYL)ISOPROPYLAMINE;SCHEMBL1099886;[(2H-1,3-benzodioxol-5-yl)methyl](propan-2-yl)amine;DTXSID90299643;HMS1672K16;BBL018616;MFCD02040873;STK145624;AKOS000311676;CCG-311421;NSC-131714;EN300-162770;[(1,3-dioxaindan-5-yl)methyl](propan-2-yl)amine;N-[(2H-1,3-Benzodioxol-5-yl)methyl]propan-2-amine

Suppliers and Price of N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine

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

TRC
N-(1,3-Benzodioxol-5-ylmethyl)-2-propanamineHydrochloride
500mg
$ 75.00

American Custom Chemicals Corporation
(1,3-BENZODIOXOL-5-YLMETHYL)ISOPROPYLAMINE 95.00%
5MG
$ 496.27

Total 8 raw suppliers

Chemical Property of N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine

Chemical Property:

Vapor Pressure:0.00578mmHg at 25°C
Boiling Point:273.3°Cat760mmHg
Flash Point:109.5°C
PSA：30.49000
Density:1.1g/cm³
LogP:2.30420
XLogP3:2.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:193.110278721
Heavy Atom Count:14
Complexity:184

Purity/Quality:

NLT 98% ^*data from raw suppliers

N-(1,3-Benzodioxol-5-ylmethyl)-2-propanamineHydrochloride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(C)NCC1=CC2=C(C=C1)OCO2

Technology Process of N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine

There total 6 articles about N-(1,3-benzodioxol-5-ylmethyl)propan-2-amine 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: 98.0%

: 2620-50-0
1,3-benzodioxol-5-ylmethyl amine

: 108-18-9
diisopropylamine

: 68291-92-9
N-(benzo[1,3]dioxol-5-ylmethyl)propan-2-amine

Guidance literature:: With μ-diiodo-di((η5-pentamethylcyclopentadienyl)(iodo)iridium); In 5,5-dimethyl-1,3-cyclohexadiene; at 155 ℃; for 10h; Inert atmosphere;
DOI:10.1002/anie.200904028

Reference yield: 80.0%

: 2620-50-0
1,3-benzodioxol-5-ylmethyl amine

: 67-64-1
acetone

: 68291-92-9
N-(benzo[1,3]dioxol-5-ylmethyl)propan-2-amine

Guidance literature:: 1,3-benzodioxol-5-ylmethyl amine; acetone; Reflux;

With palladium 10% on activated carbon; hydrogen; In methanol; at 20 ℃; under 2250.23 Torr; Autoclave;

Reference yield:

: 120-57-0,30024-74-9
piperonal

: propan-2-amine hydrochloride

: 68291-92-9
N-(benzo[1,3]dioxol-5-ylmethyl)propan-2-amine

Guidance literature:: piperonal; propan-2-amine hydrochloride; With triethylamine; In tetrahydrofuran; at 50 ℃; for 4h;

With palladium 10% on activated carbon; hydrogen; In tetrahydrofuran; at 20 ℃; for 12h;
DOI:10.1016/j.bioorg.2020.104166