4-[(3-nitrophenyl)carbamoyl]butanoic Acid

Base Information

Chemical Name:4-[(3-nitrophenyl)carbamoyl]butanoic Acid
CAS No.:25901-27-3
Molecular Formula:C₁₁H₁₂N₂O₅
Molecular Weight:252.227
Hs Code.:
European Community (EC) Number:665-986-2
ChEMBL ID:CHEMBL1508648
Mol file:25901-27-3.mol

Synonyms:4-[(3-nitrophenyl)carbamoyl]butanoic Acid;25901-27-3;5-(3-nitroanilino)-5-oxopentanoic acid;5-((3-Nitrophenyl)amino)-5-oxopentanoic acid;5-[(3-nitrophenyl)amino]-5-oxopentanoic acid;3'-nitroglutaranilic acid;Cambridge id 5259628;Oprea1_761157;MLS000776567;SCHEMBL7825577;CHEMBL1508648;HMS2670F05;BBL000764;MFCD00029876;STK133618;AKOS001025832;SMR000371813;VS-00719;CS-0238160;5-((3-Nitrophenyl)amino)-5-oxopentanoicacid;EN300-190876;SR-01000201615;SR-01000201615-1;Z56755401

Suppliers and Price of 4-[(3-nitrophenyl)carbamoyl]butanoic Acid

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.
N-Methyl-2,4-dinitroaniline
0.5 g
$ 1880.00

Medical Isotopes, Inc.
N-Methyl-2,4-dinitroaniline
100 mg
$ 860.00

Total 18 raw suppliers

Chemical Property of 4-[(3-nitrophenyl)carbamoyl]butanoic Acid

Chemical Property:

Melting Point:171-172°C
Boiling Point:540.0±35.0 °C(Predicted)
PKA:4.62±0.10(Predicted)
PSA：112.22000
Density:1.412±0.06 g/cm3(Predicted)
LogP:2.38440
XLogP3:1.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:252.07462149
Heavy Atom Count:18
Complexity:326

Purity/Quality:

99% ^*data from raw suppliers

N-Methyl-2,4-dinitroaniline ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC(=C1)[N+](=O)[O-])NC(=O)CCCC(=O)O

Technology Process of 4-[(3-nitrophenyl)carbamoyl]butanoic Acid

There total 1 articles about 4-[(3-nitrophenyl)carbamoyl]butanoic Acid 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:

: 25901-27-3
N-(3-Nitrophenyl)-glutaramidsaeure

Guidance literature:: Glutarsaeureanhydrid, 3-Nitroanilin;

Reference yield:

: 25901-27-3
N-(3-Nitrophenyl)-glutaramidsaeure

: 81305-76-2
2,6-Dichlor-3,5-diformyl-1,4-dihydro-1-(3-nitrophenyl)-pyridin

Guidance literature:: With N,N-dimethyl-formamide; trichlorophosphate; at 100 ℃;

Reference yield:

: 25901-27-3
N-(3-Nitrophenyl)-glutaramidsaeure

: 81305-80-8
8-(3-Nitro-phenyl)-1,7-diphenyl-1,4,7,8-tetrahydro-dipyrazolo[3,4-b;4',3'-e]pyridine

Guidance literature:: Multi-step reaction with 2 steps

1: DMF, POCl₃ / 100 °C

2: 62 percent / glacial acetic acid / Heating

With acetic acid; N,N-dimethyl-formamide; trichlorophosphate;