1,1'-(1,3-Phenylene)diethanone

Basic Information

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CAS Number

6781-42-6

Molecular Formula

C10H10O2

Molecular Weight

162.19 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

Basic Physical Properties

Melting Point

28-32 °C

Boiling Point

150-155 °C/15 mmHg

Density

1.0613 (rough estimate)

Solubility

Soluble in ethanol, benzene, chloroform.

Refractive Index

1.5485-1.5505

SMILES

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

InChI

InChI=1S/C10H10O2/c1-7(11)9-4-3-5-10(6-9)8(2)12/h3-6H,1-2H3

InChIKey

VCHOFVSNWYPAEF-UHFFFAOYSA-N

LogP

2.0918

Topological Polar Surface Area

34.14 Å²

Hydrogen Bond Donor/Acceptor

0 / 2

Complexity

176

Synonyms & References

English

AMY11160
1-(3-acetylphenyl)ethanone
Ethanone,1,1'-(1,3-phenylene)bis-
m-Acetyl acetophenone
meta-diacetylbenzene
m-diacetyl benzene
1,1'-(1,3-phenylene)diethanone
Ethanone, 1,1'-(1,3-phenylene)bis-
NS00010798
AKOS004900787
1,3-Diacetylbenzene, 97%
SCHEMBL279656
6781-42-6
InChI=1/C10H10O2/c1-7(11)9-4-3-5-10(6-9)8(2)12/h3-6H,1-2H
1,3-DIACETYLBENZENE
DTXSID80218060
CS-11495
m-Diacetylbenzene
M-acetylacetophenone
1-(3-Acetylphenyl)ethan-1-one
EINECS 229-842-9
SY022506
FT-0606607
CS-W017931
D2617
A835893
3-CH3CO-C6H4-COCH3
MFCD00008740
Benzene-1,3-bis(acetyl)
1,3-Diacetylbenzene
benzene-1,3-bis(acetyl)

MDL Number

MFCD00008740

Customs Code

2914399090

FAQ

What is 1,1'-(1,3-Phenylene)diethanone (CAS: 6781-42-6)?

1,1'-(1,3-Phenylene)diethanone, also known as 1,3-phenylenebis(ethanone), is a organic compound with the chemical formula C8H10O2. It is a colorless crystalline solid with a molecular weight of 142.17 g/mol. This compound is characterized by its planar structure and is used in various applications due to its chemical stability and reactivity.

What are the main uses of 1,1'-(1,3-Phenylene)diethanone (CAS: 6781-42-6)?

1,1'-(1,3-Phenylene)diethanone is primarily used in the production of resins and polyurethane precursors. It also serves as a monomer in the synthesis of various polymers and is utilized in the pharmaceutical industry for the production of certain drugs. Additionally, it is employed in the preparation of dyes and pigments.

Is 1,1'-(1,3-Phenylene)diethanone (CAS: 6781-42-6) safe?

1,1'-(1,3-Phenylene)diethanone is generally considered safe for industrial use when handled properly. However, it may cause eye and skin irritation if not handled with care. It is important to wear appropriate personal protective equipment such as gloves and safety glasses when working with this compound. Storage and handling should comply with standard safety regulations.

How should 1,1'-(1,3-Phenylene)diethanone (CAS: 6781-42-6) be stored?

1,1'-(1,3-Phenylene)diethanone should be stored in a cool, dry place away from direct sunlight and heat sources. It is recommended to store it in a tightly sealed container to prevent exposure to air and moisture. The storage area should be well-ventilated. It is also important to keep it out of reach of children and pets. Proper labeling and documentation should be maintained to ensure safe handling and storage.