5-Acetyl-1,3-phenylene diacetate

Basic Information

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CAS Number

35086-59-0

Molecular Formula

C12H12O5

Molecular Weight

236.22 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 Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

91.0 to 95.0 deg-C

Boiling Point

165-168 ºC (0.75 torr)

Refractive Index

1.5140 (estimate)

SMILES

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

InChI

InChI=1S/C12H12O5/c1-7(13)10-4-11(16-8(2)14)6-12(5-10)17-9(3)15/h4-6H,1-3H3

InChIKey

QODJHYBESCIPOG-UHFFFAOYSA-N

LogP

1.7398

Topological Polar Surface Area

69.67 Å²

Hydrogen Bond Donor/Acceptor

0 / 5

Complexity

299

Safety Information

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Hazard Statement

Synonyms & References

English

3,5-Diacetoxy Acetophenone
EINECS 252-354-2
FT-0614486
3',5'-Diacetyloxyacetophenone
3',5'-Diacetoxyacetophenone
AC-14655
ETHANONE, 1-(3,5-BIS(ACETYLOXY)PHENYL)-
AS-9407
35086-59-0
SCHEMBL414964
MFCD00008702
1-(3,5-BIS(ACETYLOXY)PHENYL)ETHANONE
(3-acetyl-5-acetyloxyphenyl) acetate
UNII-FO164JM5H5
D1978
5-Acetyl-1,3-phenylene diacetate
BCP12409
5-Acetyl-1,3-phenylenediacetate
AKOS015837946
NS00020800
FO164JM5H5
3-acetyl-5-(acetyloxy)phenyl acetate
3,5-Diacetoxyacetophenone
Ethanone, 1-[3,5-bis(acetyloxy)phenyl]-
DTXSID90188583
ZB1801
(3-acetoxy-5-acetyl-phenyl) acetate
W-110854
A822525
acetic acid (3-acetyl-5-acetyloxyphenyl) ester
CS-0313008

MDL Number

MFCD00008702

Customs Code

2918300090

FAQ

What is 5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0)?

5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) is a chemical compound with the molecular formula C12H10O6. It is a white crystalline solid with a pungent odor. This compound is primarily used in the synthesis of other organic compounds and as a reagent in organic chemistry.

What are the main uses of 5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0)?

5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) is mainly used as a reagent in organic synthesis, particularly in the preparation of other acetates and acetyl derivatives. It is also used in the synthesis of pharmaceuticals and as an intermediate in industrial processes.

Is 5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) safe?

5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) is generally safe when handled with appropriate precautions. It is important to avoid contact with skin and eyes, and to use proper personal protective equipment. Ingestion or inhalation should be avoided, and storage should be in a cool, dry place away from direct sunlight.

How should 5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) be stored?

5-Acetyl-1,3-phenylene diacetate (CAS: 35086-59-0) should be stored in a tightly sealed container in a cool, dry place, away from direct sunlight and heat sources. It should be kept at a temperature below 25°C and protected from moisture and air to maintain its stability.