2-Hydroxy-5-methylbenzophenone

Base Information

• Chemical Name: 2-Hydroxy-5-methylbenzophenone
• CAS No.: 1470-57-1
• Molecular Formula: C14H12O2
• Molecular Weight: 212.248
• Hs Code.: 29145000
• European Community (EC) Number: 216-002-1
• NSC Number: 296
• UNII: 85W615BMP7
• DSSTox Substance ID: DTXSID9047881
• Nikkaji Number: J206.675K
• Wikidata: Q27269675
• ChEMBL ID: CHEMBL25139
• Mol file: 1470-57-1.mol

Synonyms:2-Hydroxy-5-methylbenzophenone;1470-57-1;(2-hydroxy-5-methylphenyl)(phenyl)methanone;2-Benzoyl-4-methylphenol;(2-hydroxy-5-methylphenyl)-phenylmethanone;Methanone, (2-hydroxy-5-methylphenyl)phenyl-;UNII-85W615BMP7;5-Methyl-2-hydroxybenzophenone;DTXSID9047881;NSC-296;85W615BMP7;Benzophenone, 2-hydroxy-5-methyl-;EINECS 216-002-1;(2-Hydroxy-5-methylphenyl)phenylmethanone;NSC296;2-Hydroxy-5-Methyl-Benzophenone;Methanone,(2-hydroxy-5-methylphenyl)phenyl-;C10H11BrN2O3.xCa;Oprea1_337237;CHEMBL25139;SCHEMBL147250;DTXCID5027857;NSC 296;C10-H11-Br-N2-O3.x-Ca;Tox21_200544;MFCD00002379;2-Hydroxy-5-methylbenzophenone, 99%;AKOS002942520;2-HYDROXY-5-METHYL BENZOPHENONE;NCGC00248690-01;NCGC00258098-01;AS-66198;CAS-1470-57-1;CS-0280295;FT-0755816;H1008;(2-Hydroxy-5-methyl-phenyl)-phenyl-methanone;D90989;EN300-1276912;SR-01000391497;J-008305;SR-01000391497-1;Q27269675;Barbituric acid, 5-allyl-5-(2-bromoallyl)-, calcium salt

Chemical Property of 2-Hydroxy-5-methylbenzophenone

Chemical Property:

• Appearance/Colour: yellow crystalline powder
• Vapor Pressure: 4.44E-05mmHg at 25°C
• Melting Point: 83-85 °C(lit.)
• Refractive Index: 1.604
• Boiling Point: 340.2 °C at 760 mmHg
• PKA: 8.24±0.43(Predicted)
• Flash Point: 144.8 °C
• PSA: 37.30000
• Density: 1.164 g/cm³
• LogP: 2.93160
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 212.083729621
• Heavy Atom Count: 16
• Complexity: 243

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-?Hydroxy-?5-?methylbenzophenone ^*data from reagent suppliers

Safty Information:

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

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C=C1)O)C(=O)C2=CC=CC=C2
• Uses: 2-?Hydroxy-?5-?methylbenzophenone is a general reagent used in the synthesis of anti-bacterial and anti-fungal agents.

Technology Process of 2-Hydroxy-5-methylbenzophenone

There total 58 articles about 2-Hydroxy-5-methylbenzophenone 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: 98.0%

2-hydroxy-5-methylbenzaldehyde (613-84-3) + phenylboronic acid (98-80-6) → 2-hydroxy-5-methylbenzophenone (1470-57-1)

Guidance literature:

With dichloro(pentamethylcyclopentadienyl)rhodium (III) dimer; copper diacetate; In N,N-dimethyl-formamide; at 80 ℃; for 8h; Sealed tube;

DOI:10.1016/j.tet.2015.09.053

Reference yield: 95.0%

p-cresol (106-44-5) + benzoic acid (65-85-0,8013-63-6) → 2-hydroxy-5-methylbenzophenone (1470-57-1)

Guidance literature:

With boron trifluoride diethyl etherate; for 0.0333333h; microwave irradiation;

DOI:10.1246/bcsj.78.284

Reference yield: 95.0%

p-cresyl benzoate (614-34-6) → 2-hydroxy-5-methylbenzophenone (1470-57-1)

Guidance literature:

With sodium dodecyl-sulfate; for 7h; Irradiation;

upstream raw materials:

p-cresol

p-cresyl benzoate

benzoyl chloride

1-ethoxy-4-methylbenzene

Downstream raw materials:

2,6-dibenzoyl-4-methylphenol

6-methyl-3,4-diphenyl-2H-chromen-2-one

5-methyl-2-phenylacetoxybenzophenone

2-(1,1-dimethylprop-2-ynyloxy)-5-methyl-benzophenone

Refernces

• 1、 Hellwinkel et al.. "-". . p. 3241. Retrieved 1977.
• 2、 -. "ORGANIC COMPOUNDS". Page/Page column 117. . Retrieved 2021/09/11.
• 3、 Xiao, Lin,Lang, Tao-Tao,Jiang, Ying,Zang, Zhong-Lin,Zhou, Cheng-He,Cai, Gui-Xin. "Aerobic Copper-Catalyzed Salicylaldehydic Cformyl?H Arylations with Arylboronic Acids". supporting information. p. 3278 - 3283. Retrieved 2021/02/01.