(2,4-Dihydroxy-3-propylphenyl)(phenyl)methanone

Base Information

• Chemical Name: (2,4-Dihydroxy-3-propylphenyl)(phenyl)methanone
• CAS No.: 79557-81-6
• Molecular Formula: C16H16O3
• Molecular Weight: 256.301
• DSSTox Substance ID: DTXSID10515352
• Wikidata: Q82376183
• Mol file: 79557-81-6.mol

Synonyms:79557-81-6;(2,4-Dihydroxy-3-propylphenyl)(phenyl)methanone;SCHEMBL2862125;DTXSID10515352;HUANUVQIZOISIE-UHFFFAOYSA-N;2,4-Dihydroxy-3-propylbenzophenone;(2,4-dihydroxy-3-propyl-phenyl)-phenyl-methanone

Chemical Property of (2,4-Dihydroxy-3-propylphenyl)(phenyl)methanone

Chemical Property:

• XLogP3: 4.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 256.109944368
• Heavy Atom Count: 19
• Complexity: 296

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC1=C(C=CC(=C1O)C(=O)C2=CC=CC=C2)O

Technology Process of (2,4-Dihydroxy-3-propylphenyl)(phenyl)methanone

There total 3 articles about (2,4-Dihydroxy-3-propylphenyl)(phenyl)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:

2,4-dihydroxy-3-allylbenzophenone (101110-28-5) → (2,4-dihydroxy-3-propylphenyl)phenylmethanone (79557-81-6)

Guidance literature:

With hydrogen; palladium on activated charcoal;

DOI:10.1016/S0960-894X(02)01029-6

Reference yield:

2-hydroxy-4-prop-2-enyloxybenzophenone (2549-87-3) → (2,4-dihydroxy-3-propylphenyl)phenylmethanone (79557-81-6)

Guidance literature:

Multi-step reaction with 2 steps

1: 1,2-dichloro-benzene / 0.25 h / 250 °C / microwave irradiation

2: H₂ / Pd/C / ethyl acetate / 2 h / 2280 Torr

With hydrogen; palladium on activated charcoal; In ethyl acetate; 1,2-dichloro-benzene;

DOI:10.1021/jm0506930

Reference yield:

2.4-dihydroxybenzophenone (131-56-6) → (2,4-dihydroxy-3-propylphenyl)phenylmethanone (79557-81-6)

Guidance literature:

Multi-step reaction with 3 steps

1: K₂CO₃; KI / acetone / 4 h / Heating

2: 1,2-dichloro-benzene / 0.25 h / 250 °C / microwave irradiation

3: H₂ / Pd/C / ethyl acetate / 2 h / 2280 Torr

With hydrogen; potassium carbonate; potassium iodide; palladium on activated charcoal; In ethyl acetate; 1,2-dichloro-benzene; acetone;

DOI:10.1021/jm0506930

upstream raw materials:

2,4-dihydroxy-3-allylbenzophenone

2.4-dihydroxybenzophenone

2-hydroxy-4-prop-2-enyloxybenzophenone

Downstream raw materials:

(2,4-dihydroxy-3-propyl-phenyl)-phenyl-methanone oxime

6-(2-bromoeth-1-oxy)-3-phenyl-7-propylbenzisoxazole

7-propyl-3-phenyl-6-(3-bromopropyloxy)-1,2-benzisoxazole

6-(4-bromobut-1-oxy)-3-phenyl-7-propylbenzisoxazole