2,3-Dihydroxy-1,2-diphenylpropan-1-one

Base Information

• Chemical Name: 2,3-Dihydroxy-1,2-diphenylpropan-1-one
• CAS No.: 15121-78-5
• Molecular Formula: C15H14 O3
• Molecular Weight: 242.274
• Hs Code.: 2914400090
• European Community (EC) Number: 239-177-6
• DSSTox Substance ID: DTXSID90934188
• Nikkaji Number: J241.409K
• Mol file: 15121-78-5.mol

Synonyms:2,3-dihydroxy-1,2-diphenylpropan-1-one;15121-78-5;EINECS 239-177-6;2,3-Dihydroxy-2-phenylpropiophenone;alpha-methylolbenzoin;alphamethylol benzoin;alpha-methylol benzoin;2,3-dihydroxy-1,2-diphenyl-1-propanone;alpha-hydroxymethyl benzoin;alpha-(Hydroxymethyl)benzoin;SCHEMBL36374;DTXSID90934188;2,3-dihydroxy-1,2-diphenyl-propan-1-one;2,3-Dihydroxy-1,2-di(phenyl)propan-1-one

Chemical Property of 2,3-Dihydroxy-1,2-diphenylpropan-1-one

Chemical Property:

• Vapor Pressure: 2.81E-09mmHg at 25°C
• Melting Point: 85.5 °C
• Boiling Point: 460.5°Cat760mmHg
• PKA: 11.53±0.29(Predicted)
• Flash Point: 246.4°C
• PSA: 57.53000
• Density: 1.248g/cm³
• LogP: 1.74940
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 242.094294304
• Heavy Atom Count: 18
• Complexity: 278

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C(=O)C(CO)(C2=CC=CC=C2)O

Technology Process of 2,3-Dihydroxy-1,2-diphenylpropan-1-one

There total 4 articles about 2,3-Dihydroxy-1,2-diphenylpropan-1-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: 99.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + benzil (134-81-6) → α-hydroxymethylbenzoin (15121-78-5)

Guidance literature:

With titanium(III) chloride; In acetone; at 0 ℃; for 1h;

DOI:10.1021/jo00277a025

Reference yield: 76.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 2-hydroxy-2-phenylacetophenone (119-53-9,579-44-2) → α-hydroxymethylbenzoin (15121-78-5)

Guidance literature:

With potassium hydroxide; In dimethyl sulfoxide; at 20 ℃; for 0.5h;

DOI:10.1246/cl.131148

Reference yield: 60.0%

benzil (134-81-6) → α-hydroxymethylbenzoin (15121-78-5) + 2-hydroxy-2-phenylacetophenone (119-53-9,579-44-2)

Guidance literature:

With rongalite; In water; N,N-dimethyl-formamide; at 100 ℃; for 0.666667h;

upstream raw materials:

formaldehyd

2-hydroxy-2-phenylacetophenone

benzil

Downstream raw materials:

α-nitratomethylbenzoin

phenyl-4-phenyl-4-(1,3-dioxolane)ketone

(2,3-diphenyl-2-hydroxy-3-oxopropyl)-3-chloro-propionate

2,2-dibutyl-4-benzoyl-4-phenyl-1,3,2-dioxastannolane

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