1,2-Ethanediyl diacetate

Basic Information

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CAS Number

111-55-7

Molecular Formula

C6H10O4

Molecular Weight

146.14 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Physical Properties

Melting Point

−41 °C

Boiling Point

190°C

Water Solubility

160 g/L (20 ºC)

Solubility

160g/l

Refractive Index

n20/D 1.415(lit.)

Vapor Pressure

0.2 mmHg ( 20 °C)

SMILES

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CC(=O)OCCOC(=O)C

InChI

InChI=1S/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H3

InChIKey

JTXMVXSTHSMVQF-UHFFFAOYSA-N

LogP

0.11260000000000003

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

114

Safety Information

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Explosive Limit

1.6%, 135°F

Toxicity

LD50 orally in rats: 6.86 g/kg (Smyth)

Synonyms & References

English

1,2-Ethanediol, diacetate
Aptex Donor H-plus
Glycol diacetate
4-02-00-00217 (Beilstein Handbook Reference)
EINECS 203-881-1
NCGC00257469-01
2-(Acetyloxy)ethyl acetate #
NSC8853
HSDB 430
2-acetyloxyethyl acetate
J-002597
DTXCID606880
9E5JC3Q7WJ
Tox21_303428
ETHYLENE GLYCOL DIDEUTEROACETYL ESTER
AKOS015913751
EC 203-881-1
ethyleneglycol diacetate
Ethylene gycol diacetate
Ethylene diethanoate
1,2-Diacetoxyethane
MFCD00008718
ETHYLENE GLYCOL DIACETATE [HSDB]
DTXSID0026880
Q27272433
1,2-Ethanediol diacetate
InChI=1/C6H10O4/c1-5(7)9-3-4-10-6(2)8/h3-4H2,1-2H
CAS-111-55-7
FT-0626327
Tox21_202083
?Ethylene glycol diacetate

MDL Number

MFCD00008718

Customs Code

2915390090

FAQ

What is 1,2-Ethanediyl diacetate (CAS: 111-55-7)?

1,2-Ethanediyl diacetate (CAS: 111-55-7) is an organic compound with the chemical formula C6H12O4. It is a colorless liquid known for its ester functionality and is commonly used as a chemical intermediate. The compound is characterized by its solubility in organic solvents and its ability to undergo hydrolysis under acidic or basic conditions.

What are the main uses of 1,2-Ethanediyl diacetate (CAS: 111-55-7)?

1,2-Ethanediyl diacetate (CAS: 111-55-7) is primarily used in the pharmaceutical industry as a precursor for drug synthesis. It also finds applications in polymer science, fragrance chemistry, and as a solvent in various industrial processes. In research settings, it is utilized for developing new chemical compounds and materials.

Is 1,2-Ethanediyl diacetate (CAS: 111-55-7) safe?

1,2-Ethanediyl diacetate (CAS: 111-55-7) is generally considered safe when handled properly. However, it should be used with caution as it may cause skin and eye irritation. Safety measures include wearing appropriate personal protective equipment (PPE) and ensuring proper ventilation. It is classified as a low-toxicity chemical according to standard safety guidelines.

How should 1,2-Ethanediyl diacetate (CAS: 111-55-7) be stored?

1,2-Ethanediyl diacetate (CAS: 111-55-7) should be stored in a cool, dry, and well-ventilated area away from direct light. It is best kept in sealed, airtight containers made of materials compatible with organic solvents. Storage at temperatures below 25°C is recommended to maintain stability and prevent degradation.