2-Isobutoxy-1,2-diphenylethanone

Basic Information

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CAS Number

22499-12-3

Molecular Formula

C18H20O2

Molecular Weight

268.36 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

Not available

Boiling Point

133℃

Flash Point

185 °F

Refractive Index

n20/D 1.5485(lit.)

Vapor Pressure

0.0±0.7 mmHg at 25°C

SMILES

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CC(C)COC(C1=CC=CC=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H20O2/c1-14(2)13-20-18(16-11-7-4-8-12-16)17(19)15-9-5-3-6-10-15/h3-12,14,18H,13H2,1-2H3

InChIKey

JMVZGKVGQDHWOI-UHFFFAOYSA-N

LogP

4.2832000000000034

Topological Polar Surface Area

26.3 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

286

Safety Information

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Hazard Statement

Synonyms & References

English

Ethanone,2-(2-methylpropoxy)-1,2-diphenyl-
NS00027201
2-(2-methylpropoxy)-1,2-di(phenyl)ethanone
benzoin iso-butyl ether
BS-44063
0WOK8H9226
CS-0154212
Ethanone, 2-(2-methylpropoxy)-1,2-diphenyl-
Vicure 10
O-Isobutylbenzoin
2-Isobutoxy-2-phenylacetophenone
UNII-0WOK8H9226
E75759
Triganol
AKOS015916046
2-Isobutoxy-1,2-diphenylethanone
2-Isobutoxy-1,2-diphenylethanone #
CALCIUML-ARABONATE
MFCD00008933
Acetophenone, 2-isobutoxy-2-phenyl-
JMVZGKVGQDHWOI-UHFFFAOYSA-
DTXSID6051485
EINECS 245-039-6
FT-0700084
22499-12-3
B1015
2-(2-methylpropoxy)-1,2-diphenylethanone
Benzoin isobutyl ether
InChI=1/C18H20O2/c1-14(2)13-20-18(16-11-7-4-8-12-16)17(19)15-9-5-3-6-10-15/h3-12,14,18H,13H2,1-2H3
SCHEMBL50307
Q27237309

MDL Number

MFCD00008933

Customs Code

2914509090

FAQ

What are the physical and chemical properties of 2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3)?

2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3) is a crystalline compound with a molecular weight of approximately 314.37 g/mol. It is sparingly soluble in water but soluble in organic solvents such as ethanol and acetone. Chemically, it is relatively stable under normal conditions but can react with strong acids or bases. It has a melting point of 52-54°C.

How is 2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3) typically synthesized?

2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3) is typically synthesized via the reaction of isobutyronitrile with phenylacetyl chloride in the presence of a base such as triethylamine. The reaction yields a high selectivity and good yield, making it a versatile intermediate in organic synthesis.

What industries use 2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3)?

2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3) is primarily used in the pharmaceutical industry as an intermediate for the synthesis of certain drugs. It is also used in the polymer industry for functionalization and modification of polymers, and has potential applications in sensors and semiconductors.

What precautions should be taken when handling 2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3)?

When handling 2-Isobutoxy-1,2-diphenylethanone (CAS: 22499-12-3), it is important to wear appropriate personal protective equipment (PPE) such as gloves and safety goggles. This compound should be used in a well-ventilated area or a fume hood to minimize inhalation risk. Spills should be handled with caution, and the area should be thoroughly cleaned with water and appropriate solvents. Always refer to the Safety Data Sheet (SDS) for detailed safety information.