Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone

Base Information

Chemical Name:Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone
CAS No.:125628-95-7
Molecular Formula:C₁₃H₁₅NO₅
Molecular Weight:265.266
Hs Code.:
DSSTox Substance ID:DTXSID00154810
Wikidata:Q83022154
Mol file:125628-95-7.mol

Synonyms:Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone;Methanone, cyclohexyl(3,4-dihydroxy-5-nitrophenyl)-;125628-95-7;DTXSID00154810;LS-91183

Suppliers and Price of Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone

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 2 raw suppliers

Chemical Property of Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone

Chemical Property:

Vapor Pressure:8.07E-08mmHg at 25°C
Boiling Point:424.9°Cat760mmHg
Flash Point:178.6°C
Density:1.38g/cm³
XLogP3:3.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:2
Exact Mass:265.09502258
Heavy Atom Count:19
Complexity:347

Purity/Quality:: 98%min ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CCC(CC1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-]

Technology Process of Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone

There total 6 articles about Cyclohexyl(3,4-dihydroxy-5-nitrophenyl)methanone 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: 55.5%

: 125629-27-8
cyclohexyl 4-hydroxy-3-methoxy-5-nitrophenyl ketone

: 125628-95-7
cyclohexyl 3,4-dihydroxy-5-nitrophenyl ketone

Guidance literature:: With hydrogen bromide; In acetic acid; for 20h; Heating;
DOI:10.1002/hlca.19890720511

Reference yield:

: 108-85-0
1-bromocyclohexane

: 125628-95-7
cyclohexyl 3,4-dihydroxy-5-nitrophenyl ketone

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) Mg, I₂ / 1.) Et₂O, reflux, 2 h; 2.) THF, Et₂O, 0 deg C, 2 h

2: 64.3 percent / pyridinium chlorochromate / CH₂Cl₂ / 1.) 5 deg C, 3 h; 2.) room temp. 17 h

3: 77.4 percent / HBr/AcOH / CH₂Cl₂ / 2 h / Ambient temperature

4: 75.8 percent / 65percent / HNO₃ / acetic acid / 1.5 h / Ambient temperature

5: 55.5 percent / 48percent HBr / acetic acid / 20 h / Heating

With hydrogen bromide; iodine; magnesium; acetic acid; pyridinium chlorochromate; nitric acid; In dichloromethane; acetic acid;
DOI:10.1002/hlca.19890720511

Reference yield:

: 2426-87-1
3-methoxy-4-(phenylmethoxy)benzaldehyde

: 125628-95-7
cyclohexyl 3,4-dihydroxy-5-nitrophenyl ketone

Guidance literature:: Multi-step reaction with 5 steps

1: 1.) Mg, I₂ / 1.) Et₂O, reflux, 2 h; 2.) THF, Et₂O, 0 deg C, 2 h

2: 64.3 percent / pyridinium chlorochromate / CH₂Cl₂ / 1.) 5 deg C, 3 h; 2.) room temp. 17 h

3: 77.4 percent / HBr/AcOH / CH₂Cl₂ / 2 h / Ambient temperature

4: 75.8 percent / 65percent / HNO₃ / acetic acid / 1.5 h / Ambient temperature

5: 55.5 percent / 48percent HBr / acetic acid / 20 h / Heating

With hydrogen bromide; iodine; magnesium; acetic acid; pyridinium chlorochromate; nitric acid; In dichloromethane; acetic acid;
DOI:10.1002/hlca.19890720511