1-Iodo-3-nitrobenzene

Base Information Edit

Chemical Name:1-Iodo-3-nitrobenzene
CAS No.:645-00-1
Molecular Formula:C6H4INO2
Molecular Weight:249.008
Hs Code.:29049090
European Community (EC) Number:211-427-9
NSC Number:3538
UN Number:1325
UNII:F6TCH3TLL9
DSSTox Substance ID:DTXSID5025449
Nikkaji Number:J96.180I
Wikidata:Q27135633
Metabolomics Workbench ID:64927
ChEMBL ID:CHEMBL115511
Mol file:645-00-1.mol

Synonyms:1-Iodo-3-nitrobenzene;645-00-1;3-Iodonitrobenzene;M-IODONITROBENZENE;Benzene, 1-iodo-3-nitro-;3-nitroiodobenzene;M-NITROIODOBENZENE;meta-iodonitrobenzene;3-iodo-1-nitrobenzene;1-Iodo-3-nitro-benzene;3-I-nitrobenzene;iodo-3-nitrobenzene;meta-nitroiodobenzene;NSC 3538;EINECS 211-427-9;F6TCH3TLL9;AI3-15390;DTXSID5025449;CHEBI:67123;NSC-3538;NSC3538;3-nitro-iodobenzen;m-nitro-iodobenzene;3-nitro-iodobenzene;MFCD00007218;1iodo-3-nitrobenzene;1-Iiodo-3-nitrobenzene;1 -iodo-3-nitrobenzene;UNII-F6TCH3TLL9;M-NITROPHENYL IODIDE;3-NITROPHENYL IODIDE;ghl.PD_Mitscher_leg0.931;MLS002152852;SCHEMBL177151;3-NITRO-1-IODOBENZENE;CHEMBL115511;DTXCID105449;1-Iodo-3-nitrobenzene, 99%;IODO-3-NITROBENZENE, 1-;Tox21_201085;AKOS009156587;GS-3279;LS-1548;NCGC00091693-01;NCGC00091693-02;NCGC00258637-01;AC-22936;CAS-645-00-1;SMR001224476;A8828;AM20040949;FT-0615905;I0063;EN300-175865;W-104833;Q27135633

Suppliers and Price of 1-Iodo-3-nitrobenzene

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

TRC
1-Iodo-3-nitrobenzene
1g
$ 50.00

TCI Chemical
1-Iodo-3-nitrobenzene >98.0%(GC)
25g
$ 98.00

Sigma-Aldrich
1-Iodo-3-nitrobenzene 99%
25g
$ 106.00

Medical Isotopes, Inc.
1-Iodo-3-nitrobenzene
5 g
$ 625.00

Frontier Specialty Chemicals
1-Iodo-3-nitrobenzene 99%
25g
$ 83.00

AOBChem
1-Iodo-3-nitrobenzene 97%
100g
$ 65.00

Alfa Aesar
1-Iodo-3-nitrobenzene, 99%
25g
$ 45.40

Alfa Aesar
1-Iodo-3-nitrobenzene, 99%
100g
$ 125.00

AK Scientific
1-Iodo-3-nitrobenzene
100g
$ 131.00

AHH
1-Iodo-3-nitrobenzene 98%
500g
$ 418.00

Total 54 raw suppliers

Chemical Property of 1-Iodo-3-nitrobenzene Edit

Chemical Property:

Appearance/Colour:yellow to yellow-green powder
Vapor Pressure:0.0063mmHg at 25°C
Melting Point:36-38 °C(lit.)
Refractive Index:1.663
Boiling Point:280.8 °C at 760 mmHg
Flash Point:71.7 °C
PSA：45.82000
Density:2.018 g/cm₃
LogP:2.72260
Storage Temp.:Refrigerator (+4°C) + Flammables area
Sensitive.:Light Sensitive
Water Solubility.:insoluble
XLogP3:2.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:248.92868
Heavy Atom Count:10
Complexity:134
Transport DOT Label:Flammable Solid

Purity/Quality:

98% ^*data from raw suppliers

1-Iodo-3-nitrobenzene ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xn, F, Xi
Hazard Codes:Xn,F,Xi
Statements: 20/21/22-36/37/38-36-33-11
Safety Statements: 26-36/37/39-45-16-36

MSDS Files:: SDS file from LookChem

Useful:

Chemical Classes:Nitrogen Compounds -> Nitros, Aromatic
Canonical SMILES:C1=CC(=CC(=C1)I)[N+](=O)[O-]
Uses 1-Iodo-3-nitrobenzene was used in the synthesis of 5-substituted pyrrolo[3,2-b]pyridine amide and 3′-nitro-4-methylthiobiphenyl. It was used in palladium(0) catalyzed cross-coupling reaction between heteroarylzinc iodide and unsaturated iodide.

Technology Process of 1-Iodo-3-nitrobenzene

There total 44 articles about 1-Iodo-3-nitrobenzene 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: 99.0%