Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-

Base Information

Chemical Name:Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-
CAS No.:68239-25-8
Molecular Formula:C8H8N2O3
Molecular Weight:184.131
Hs Code.:
European Community (EC) Number:269-437-4
DSSTox Substance ID:DTXSID701287593
Nikkaji Number:J289.080A
Mol file:68239-25-8.mol

Synonyms:68239-25-8;Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-;4'-NITROACETANILIDE-2',3',5',6'-D4;N-(2,3,5,6-tetradeuterio-4-nitrophenyl)acetamide;N-(4-Nitrophenyl)acetamide-d4;EINECS 269-437-4;4'-Nitro-2',3',5',6'-tetradeuteroacetanilide;C8H4D4N2O3;C8-H4-D4-N2-O3;N-(4-Nitro(2,3,5,6-2H4)phenyl)acetamide;N-(4-nitro[2,3,5,6-2H4]phenyl)acetamide;DTXSID701287593;HY-W087930S;N-(4-Nitrophenyl-2,3,5,6-d4)acetamide;CS-0621024;D98199

Suppliers and Price of Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-

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

Medical Isotopes, Inc.
4?-Nitroacetanilide-2?,3?,5?,6?-d4
1 g
$ 1530.00

Medical Isotopes, Inc.
4?-Nitroacetanilide-2?,3?,5?,6?-d4
0.5 g
$ 855.00

American Custom Chemicals Corporation
4'-NITROACETANILIDE-2',3',5',6'-D4 95.00%
5MG
$ 502.68

Total 5 raw suppliers

Chemical Property of Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-

Chemical Property:

Vapor Pressure:6.77E-07mmHg at 25°C
Boiling Point:408.9°Cat760mmHg
Flash Point:201.1°C
PSA：74.92000
Density:1.37g/cm³
LogP:2.14940
XLogP3:1.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:184.07859911
Heavy Atom Count:13
Complexity:204

Purity/Quality:

99% ^*data from raw suppliers

4?-Nitroacetanilide-2?,3?,5?,6?-d4 ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)NC1=CC=C(C=C1)[N+](=O)[O-]
Isomeric SMILES:[2H]C1=C(C(=C(C(=C1NC(=O)C)[2H])[2H])[N+](=O)[O-])[2H]
Uses 4''-Nitroacetanilide-2'',3'',5'',6''-d4 (CAS# 68239-25-8) is a useful isotopically labeled research compound.

Technology Process of Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)-

There total 4 articles about Acetamide, N-(4-nitrophenyl-2,3,5,6-d4)- 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: 70.4%

: 15826-91-2
acetanilide-d5

: 68239-25-8
4-nitroacetanilide-2,3,5,6-d4

Guidance literature:: With sulfuric acid-d2; nitric acid-d1; In water-d2; at -10 - 5 ℃; for 6h;
DOI:10.1246/bcsj.68.1024

Reference yield:

: 4165-61-1
aniline-d5

: 68239-25-8
4-nitroacetanilide-2,3,5,6-d4

Guidance literature:: Multi-step reaction with 2 steps

1: 94.1 percent / benzene / Heating

2: 70.4 percent / DNO₃, D₂SO₄ / D₂O / 6 h / -10 - 5 °C

With sulfuric acid-d2; nitric acid-d1; In water-d2; benzene;
DOI:10.1246/bcsj.68.1024

Reference yield:

: 4165-60-0
nitrobenzene-d5

: 68239-25-8
4-nitroacetanilide-2,3,5,6-d4

Guidance literature:: Multi-step reaction with 3 steps

1: 91 percent / Fe, HCl / H₂O

2: acetic acid / Heating

3: HNO₃, H₂SO₄

With hydrogenchloride; sulfuric acid; nitric acid; iron; In water; acetic acid;
DOI:10.1016/0022-328X(85)80272-2