3-(Pyrimidin-4-yl)aniline

Base Information

Chemical Name:3-(Pyrimidin-4-yl)aniline
CAS No.:16496-10-9
Molecular Formula:C10H9 N3
Molecular Weight:171.19856
Hs Code.:2933599090
DSSTox Substance ID:DTXSID50499006
Mol file:16496-10-9.mol

Synonyms:3-(pyrimidin-4-yl)aniline;16496-10-9;3-pyrimidin-4-ylaniline;Benzenamine, 3-(4-pyrimidinyl)- (9CI);4-(3-Aminophenyl)pyrimidine;SCHEMBL2643441;DTXSID50499006;MJLDVXLWYAVOLO-UHFFFAOYSA-N;Benzenamine, 3-(4-pyrimidinyl)-;SB56431

Suppliers and Price of 3-(Pyrimidin-4-yl)aniline

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

Crysdot
3-(Pyrimidin-4-yl)aniline 97%
10g
$ 1836.00

Crysdot
3-(Pyrimidin-4-yl)aniline 97%
5g
$ 1340.00

Crysdot
3-(Pyrimidin-4-yl)aniline 97%
1g
$ 644.00

Total 1 raw suppliers

Chemical Property of 3-(Pyrimidin-4-yl)aniline

Chemical Property:

Melting Point:131-132 °C(Solv: ethanol (64-17-5))
Boiling Point:388.2±25.0 °C(Predicted)
PKA:3.42±0.10(Predicted)
PSA：51.80000
Density:1.193±0.06 g/cm3(Predicted)
LogP:2.30700
XLogP3:1.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:171.079647300
Heavy Atom Count:13
Complexity:160

Purity/Quality:: 3-(Pyrimidin-4-yl)aniline 97% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)N)C2=NC=NC=C2

Technology Process of 3-(Pyrimidin-4-yl)aniline

There total 3 articles about 3-(Pyrimidin-4-yl)aniline 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:

: 873566-58-6
2,4-dichloro-6-(3-nitrophenyl) pyrimidine

: 16496-10-9
3-(pyrimidin-4-yl)aniline

Guidance literature:: With palladium 10% on activated carbon; hydrogen; sodium acetate; In water; ethyl acetate; for 6h;

Reference yield:

: 13331-27-6
m-nitrobenzene boronic acid

: 16496-10-9
3-(pyrimidin-4-yl)aniline

Guidance literature:: Multi-step reaction with 2 steps

1: sodium carbonate; tetrakis(triphenylphosphine) palladium⁽⁰⁾ / 1,2-dimethoxyethane / 16 h / 20 - 80 °C / Inert atmosphere

2: palladium 10% on activated carbon; hydrogen; sodium acetate / water; ethyl acetate / 6 h

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; palladium 10% on activated carbon; hydrogen; sodium acetate; sodium carbonate; In 1,2-dimethoxyethane; water; ethyl acetate;