4-(5-Nitro-2-furyl)-3-butene-2-one

Base Information

Chemical Name:4-(5-Nitro-2-furyl)-3-butene-2-one
CAS No.:3455-61-6
Molecular Formula:C₈H₇NO₄
Molecular Weight:181.148
Hs Code.:2932190090
NSC Number:58181
Nikkaji Number:J55.493F
Mol file:3455-61-6.mol

Synonyms:4-(5-Nitro-2-furyl)-3-butene-2-one;3455-61-6;NF 150;(E)-4-(5-nitrofuran-2-yl)but-3-en-2-one;3-Buten-2-one, 4-(5-nitro-2-furanyl)-;NSC 58181;3-BUTEN-2-ONE, 4-(5-NITRO-2-FURYL)-;AI3-23619;NSC58181;SCHEMBL13113129;WLN: T5OJ BNW E1U1V1;NSC-58181;AKOS004903254;4-(5-Nitro-2-furyl)-3-buten-2-one;4-(5-nitrofuran-2-yl)but-3-en-2-one;73866-77-0;LS-47321;EN300-1856649;3-Buten-2-one, 4-(5-nitro-2-furanyl)- (9CI);Z56754192;(3e)-4-(5-nitro-2-furyl)but-3-en-2-one (en)3-buten-2-one, 4-(5-nitro-2-furanyl)- (en)

Suppliers and Price of 4-(5-Nitro-2-furyl)-3-butene-2-one

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
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price

Total 1 raw suppliers

Chemical Property of 4-(5-Nitro-2-furyl)-3-butene-2-one

Chemical Property:

Vapor Pressure:0.000374mmHg at 25°C
Boiling Point:317.9°Cat760mmHg
Flash Point:146°C
PSA：76.03000
Density:1.306g/cm³
LogP:2.31320
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:181.03750770
Heavy Atom Count:13
Complexity:243

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)C=CC1=CC=C(O1)[N+](=O)[O-]
Isomeric SMILES:CC(=O)/C=C/C1=CC=C(O1)[N+](=O)[O-]

Technology Process of 4-(5-Nitro-2-furyl)-3-butene-2-one

There total 1 articles about 4-(5-Nitro-2-furyl)-3-butene-2-one 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:

: 3455-61-6
1-(5-nitro-2-furyl)-1-buten-3-one

Guidance literature:: Acetylmethylen-triphenyl-phosphoran, 5-Nitro-furfurol, CH2Cl2 (Siedetemp., 5h, unter N2);

Reference yield:

: 873-67-6
benzonitrile oxide

: 3455-61-6
1-(5-nitro-2-furyl)-1-buten-3-one

: 32023-64-6
1-[5-(5-nitro-furan-2-yl)-3-phenyl-4,5-dihydro-isoxazol-4-yl]-ethanone

: 32023-65-7
1-[4-(5-nitro-furan-2-yl)-3-phenyl-4,5-dihydro-isoxazol-5-yl]-ethanone

Guidance literature:: With triethylamine; In benzene; Ambient temperature;
DOI:10.1246/bcsj.44.803

Reference yield:

: 3455-61-6
1-(5-nitro-2-furyl)-1-buten-3-one

: 97039-14-0
3-<2-(5-nitro-2-furyl)vinylen>-2-isoxazoline

Guidance literature:: Multi-step reaction with 4 steps

1: 31 percent / ethanol / 7 h / Heating

2: 51 percent / hydroxylamine hydrochloride / H₂O / 0.33 h / 50 °C

3: 79 percent / acetone / RT, 12 h; reflux, 60 min

4: 70 percent / N ethanolic KOH / ethanol / 0.08 h / Heating

With potassium hydroxide; hydroxylamine hydrochloride; In ethanol; water; acetone;