4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

Base Information

Chemical Name:4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one
CAS No.:91134-02-0
Molecular Formula:C11H13 N O4
Molecular Weight:223.229
Hs Code.:
NSC Number:163426
DSSTox Substance ID:DTXSID30919934
Nikkaji Number:J1.845.806C

Synonyms:91134-02-0;4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one;NSC163426;DTXSID30919934;NSC-163426

Suppliers and Price of 4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-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
Packaging
price

Total 5 raw suppliers

Chemical Property of 4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

Chemical Property:

Vapor Pressure:1.08E-06mmHg at 25°C
Boiling Point:387.3°Cat760mmHg
Flash Point:166.1°C
Density:1.244g/cm³
XLogP3:1.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:223.08445790
Heavy Atom Count:16
Complexity:266

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

Technology Process of 4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

There total 34 articles about 4-Hydroxy-3-methyl-4-(4-nitrophenyl)butan-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: 95.0%

: 555-16-8
4-nitrobenzaldehdye

: 78-93-3
butanone

: (3S,4S)-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

: 56072-29-8
1-hydroxy-1-(4-nitrophenyl)-pentan-3-one

: 59512-47-9,71444-36-5,91134-02-0
erythro-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

Guidance literature:: (1R,2R)-2-(dipropylamino)cyclohexanaminium trifluoromethanesulfonate; 3-nitrobenzoic acid; In dichloromethane; at 4 ℃;
DOI:10.1021/ja069372j

Reference yield: 71.0%

: 555-16-8
4-nitrobenzaldehdye

: 78-93-3
butanone

: 91134-02-0
syn-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

: 56072-29-8
1-hydroxy-1-(4-nitrophenyl)-pentan-3-one

Guidance literature:: With pyrrolidine; In water; for 0.5h;

Reference yield: 70.0%

: 555-16-8
4-nitrobenzaldehdye

: 78-94-4,25038-87-3
methyl vinyl ketone

: 91134-02-0
syn-4-hydroxy-3-methyl-4-(4-nitrophenyl)butan-2-one

Guidance literature:: With hydrogen; potassium acetate; triphenylphosphine; bis(cycloocta-1,5-diene)rhodium(I) trifluoromethanesulfonate; In 1,2-dichloro-ethane; at 25 ℃; under 760.051 Torr;
DOI:10.1021/ja021163l