2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-one

Base Information

• Chemical Name: 2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-one
• CAS No.: 35212-22-7
• Molecular Formula: C18H16O3
• Molecular Weight: 280.323
• Hs Code.: 29329990
• NSC Number: 755888
• ChEMBL ID: CHEMBL1372514
• Mol file: 35212-22-7.mol

Synonyms:2-phenyl-7-(propan-2-yloxy)-4h-chromen-4-one;2-phenyl-7-propan-2-yloxychromen-4-one;ipraflavone;Spectrum_000012;Spectrum3_001726;Spectrum4_000129;Spectrum5_000896;BSPBio_003372;KBioGR_000518;KBioSS_000352;DivK1c_000133;SPECTRUM1400010;CHEMBL1372514;HMS500G15;KBio1_000133;KBio2_000352;KBio2_002920;KBio2_005488;KBio3_002592;NINDS_000133;YVLFFUSZFGCFFW-UHFFFAOYSA-N;Pharmakon1600-01400010;Tox21 111532;NSC755888;CCG-213750;IDI1_000133;NCGC00095872-02;NCGC00178109-01;SBI-0051267.P002;7-(1-Methylethoxy)-2-phenyl-4H-chromen-4-one;AB00051903_02;SR-01000872735;SR-01000872735-1;BRD-K36646537-001-01-3;BRD-K36646537-001-02-1

Chemical Property of 2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-one

Chemical Property:

• Appearance/Colour: white crystalline powder
• Vapor Pressure: 8.47E-08mmHg at 25°C
• Melting Point: 116-120 °C(lit.)
• Refractive Index: 1.592
• Boiling Point: 435.9 °C at 760 mmHg
• Flash Point: 209.3 °C
• PSA: 39.44000
• Density: 1.184 g/cm³
• LogP: 4.24720
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 280.109944368
• Heavy Atom Count: 21
• Complexity: 407

Purity/Quality:

99% ^*data from raw suppliers

Ipriflavone ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 24/25-36/37/39-27-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)OC1=CC2=C(C=C1)C(=O)C=C(O2)C3=CC=CC=C3
• Description: Ipriflavone, a derivative of isoflavone, is a calcium metabolism regulator useful in the treatment of primary and secondary osteoporosis, as well as disorders of osteogenesis. It appears to be without significant side-effects.
• Uses: 7-Isopropoxy-3-phenyl-4H-1-benzopyran-4-one (Ipriflavone) has been used as a model drug in a study to functionalize the mesoporous bioactive glasses (MBG). Study suggested that since ipriflavone is a hydrophobic anti-osteoporotic drug, it easily attaches to the surface of MBG and results in long-term drug delivery. anabolic

Technology Process of 2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-one

There total 8 articles about 2-Phenyl-7-(propan-2-yloxy)-4h-chromen-4-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: 96.6%

7-hydroxyisoflavone (13057-72-2) + isopropyl bromide (75-26-3) + iso-butanol (78-92-2,15892-23-6) → Ipriflavone (35212-22-7)

Guidance literature:

With potassium carbonate; In N-methyl-acetamide; ethanol; water;

Reference yield: 96.0%

2-iodo-propane (75-30-9) + 7-hydroxyisoflavone (13057-72-2) → Ipriflavone (35212-22-7)

Guidance literature:

With potassium carbonate; In acetone; at 56 ℃;

DOI:10.1007/BF00767029

Reference yield: 93.0%

7-hydroxyisoflavone (13057-72-2) + isopropyl bromide (75-26-3) → Ipriflavone (35212-22-7)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 75 - 100 ℃; for 2.16667h;

DOI:10.1002/(SICI)1099-1344(199905)42:5<497::AID-JLCR212>3.0.CO;2-#

upstream raw materials:

2-iodo-propane

7-hydroxyisoflavone

isopropyl bromide

1-(2,4-dihydroxyphenyl)-2-phenylethanone

Downstream raw materials:

2-hydroxy-4-isopropoxybenzoic acid

methyl 2-hydroxy-4-isopropyl benzoate

3-hydroxy-5-phenyl-6-(2-hydroxy-4-isopropoxyphenyl)-1H-pyrazolo[3,4-b]pyridine

3-cyano-6-(2-hydroxy-4-isopropoxyphenyl)-5-phenylpyridine-2-(1H)-thione

Refernces

• 1、 He, Qing,Wang, Liwen,Liang, Yong,Zhang, Zunting,Wnuk, Stanislaw F.. "Transition-Metal-Free Cross-Coupling of Aryl Halides with Arylstannanes". . p. 9422 - 9427. Retrieved 2016/10/17.
• 2、 -. "COMPOUNDS USEFUL FOR THE INHIBITION OF ALDH". Page/Page column 22-23. . Retrieved 2010/11/30.