N-(4-chlorophenyl)-5-nitropyridin-2-amine

Base Information

Chemical Name:N-(4-chlorophenyl)-5-nitropyridin-2-amine
CAS No.:26820-59-7
Molecular Formula:C₁₁H₈ClN₃O₂
Molecular Weight:249.656
Hs Code.:
DSSTox Substance ID:DTXSID201268344
Nikkaji Number:J3.330.608C
ChEMBL ID:CHEMBL1726331
Mol file:26820-59-7.mol

Synonyms:N-(4-chlorophenyl)-5-nitropyridin-2-amine;26820-59-7;Oprea1_462905;MLS000717203;SCHEMBL5800553;CHEMBL1726331;REGID_for_CID_2842437;DTXSID201268344;HMS2636P12;HMS3361J18;2-(4-chloroanilino)-5-nitropyridine;AKOS000286389;SMR000278570;n-(4-chlorophenyl)-5-nitro-2-pyridineamine;N-(4-Chlorophenyl)-5-nitropyridine-2-amine;(4-Chloro-phenyl)-(5-nitropyridin-2-yl)-amine;AI-204/31709005

Suppliers and Price of N-(4-chlorophenyl)-5-nitropyridin-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

Total 4 raw suppliers

Chemical Property of N-(4-chlorophenyl)-5-nitropyridin-2-amine

Chemical Property:

Melting Point:152 - 154 °C
Boiling Point:401.4±40.0 °C(Predicted)
PKA:1.82±0.10(Predicted)
PSA：70.74000
Density:1.447±0.06 g/cm3(Predicted)
LogP:3.98300
XLogP3:3.2
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:249.0305042
Heavy Atom Count:17
Complexity:264

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC(=CC=C1NC2=NC=C(C=C2)[N+](=O)[O-])Cl

Technology Process of N-(4-chlorophenyl)-5-nitropyridin-2-amine

There total 5 articles about N-(4-chlorophenyl)-5-nitropyridin-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: 88.0%

: 4548-45-2
2-chloro-5-nitropyridine

: 106-47-8
4-chloro-aniline

: 26820-59-7
N-(4-chlorophenyl)-5-nitropyridin-2-amine

Guidance literature:: In dimethyl sulfoxide; Heating;
DOI:10.1002/kin.10053

Reference yield:

: 2403-01-2
3-nitropyridine N-oxide

: 1885-81-0
p-chlorophenyl isocyanide

: 26820-59-7
N-(4-chlorophenyl)-5-nitropyridin-2-amine

: 26820-72-4
N-(4-chlorophenyl)-3-nitro-2-pyridinamine

Guidance literature:: 3-nitropyridine N-oxide; p-chlorophenyl isocyanide; With trimethylsilyl trifluoromethanesulfonate; In methanol; acetonitrile; at 150 ℃; for 0.25h; Microwave irradiation;

With hydrogenchloride; In tetrahydrofuran; methanol; water; acetonitrile; at 50 ℃; Overall yield = 45 %; Overall yield = 35 mg;
DOI:10.1021/jo402693s

Reference yield:

: 2617-79-0
N-(4-chlorophenyl)formamide

: 26820-59-7
N-(4-chlorophenyl)-5-nitropyridin-2-amine

: 26820-72-4
N-(4-chlorophenyl)-3-nitro-2-pyridinamine

Guidance literature:: Multi-step reaction with 2 steps

1.1: triethylamine; trichlorophosphate / dichloromethane / 14 h / 0 - 23 °C

2.1: trimethylsilyl trifluoromethanesulfonate / acetonitrile; methanol / 0.25 h / 150 °C / Microwave irradiation

2.2: 50 °C

With trimethylsilyl trifluoromethanesulfonate; triethylamine; trichlorophosphate; In methanol; dichloromethane; acetonitrile;
DOI:10.1021/jo402693s