1,1',1''-Benzene-1,3,5-triyltriethanone

Basic Information

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CAS Number

779-90-8

Molecular Formula

C12H12O3

Molecular Weight

204.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

162.0 to 165.0 deg-C

Boiling Point

302.71°C (rough estimate)

Density

1.1554 (rough estimate)

Flash Point

158.7±21.7 °C

Refractive Index

1.5205 (estimate)

Vapor Pressure

0.0±0.8 mmHg at 25°C

SMILES

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CC(=O)C1=CC(=CC(=C1)C(=O)C)C(=O)C

InChI

InChI=1S/C12H12O3/c1-7(13)10-4-11(8(2)14)6-12(5-10)9(3)15/h4-6H,1-3H3

InChIKey

HSOAIPRTHLEQFI-UHFFFAOYSA-N

LogP

2.2944000000000004

Topological Polar Surface Area

51.21 Å²

Hydrogen Bond Donor/Acceptor

0 / 3

Complexity

234

Synonyms & References

English

NSC61943
EINECS 212-302-1
SY053070
AE-641/00125043
W-104290
1-(3,5-diacetylphenyl)ethan-1-one
Q27272653
9K53727S7G
NS00037966
1-(3,5-diacetylphenyl)ethanone
A839308
DTXSID50228530
UNII-9K53727S7G
Ethanone, 1,1',1''-(1,3,5-benzenetriyl)tris-
EN300-5333289
1-(3,5-DIACETYLPHENYL)-1-ETHANONE
1-(3,5-diacetylphenyl)ethanon
NSC 61943
1,3,5,Triacetylbenzene
YSZC300
1,1',1''-benzene-1,3,5-triyltriethanone
Benzene,3,5-triacetyl-
1,5-Triacetylbenzene
Cambridge id 6741393
MFCD00008741
Benzene, 1,3,5-triacetyl-
CHEMBL4542707
Ethanone,1',1''-(1,3,5-benzenetriyl)tris-
DS-7053
SCHEMBL669554
CS-0132625

MDL Number

MFCD00008741

Customs Code

2914399090

FAQ

What is 1,1',1''-Benzene-1,3,5-triyltriethanone (CAS: 779-90-8)?

1,1',1''-Benzene-1,3,5-triyltriethanone is a triketone compound with the chemical formula C18H18O3. It is an organic compound known for its stable nature and is a derivative of benzene with three ketone groups attached at the 1,3,5 positions.

What are the main uses of 1,1',1''-Benzene-1,3,5-triyltriethanone (CAS: 779-90-8)?

1,1',1''-Benzene-1,3,5-triyltriethanone is primarily used in the synthesis of other organic compounds, particularly in the pharmaceutical industry due to its reactive ketone groups. It is also used in research as a reagent for various chemical reactions.

Is 1,1',1''-Benzene-1,3,5-triyltriethanone (CAS: 779-90-8) safe?

1,1',1''-Benzene-1,3,5-triyltriethanone is generally considered safe for laboratory and industrial use when handled with proper precautions. It is important to follow safety guidelines, including wearing appropriate personal protective equipment and ensuring good ventilation.

How should 1,1',1''-Benzene-1,3,5-triyltriethanone (CAS: 779-90-8) be stored?

1,1',1''-Benzene-1,3,5-triyltriethanone should be stored in a cool, dry place, away from direct sunlight and sources of ignition. It should be kept in a tightly sealed container to prevent exposure to air and moisture. Maintain a temperature range of 15-25°C and avoid extremes of temperature and humidity.