Dimethyl 2,5-dibromohexanedioate

Basic Information

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CAS Number

868-72-4

Molecular Formula

C8H12Br2O4

Molecular Weight

331.99 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

78 ºC

Density

1.6603 g/cm3 (20 ºC)

Refractive Index

1.4910 (589.3 nm 20 ºC)

SMILES

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O=C(OC)C(Br)CCC(Br)C(OC)=O

InChI

InChI=1S/C8H12Br2O4/c1-13-7(11)5(9)3-4-6(10)8(12)14-2/h5-6H,3-4H2,1-2H3

InChIKey

HVICCJCVLLCDFQ-UHFFFAOYSA-N

LogP

1.6396

Topological Polar Surface Area

52.6 Å²

Hydrogen Bond Donor/Acceptor

0 / 4

Complexity

186

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H314 Causes severe skin burns and eye damage
Skin corrosion/irritation

Hazard Class

Class 8 Class 8

Synonyms & References

English

Dimethyl 2,5-dibromohexanedioate
DIMETHYL 2,2'-DIBROMOADIPATE
Hexanedioic acid,2,5-dibromo-, 1,6-dimethyl ester
Dimethyl 2,5-dibromoadipate
NSC 134297
Dimethyl2,2'-Dibromoadipate
Hexanedioic acid, 2,5-dibromo-, dimethyl ester
Dimethyl-2,5-Dibromoadipate
dimethyl 2,5-dibromo hexanedioate
HVICCJCVLLCDFQ-UHFFFAOYSA-N
DIMETHYL2,2-DIBROMOADIPATE
Dimethyl 2,5-dibromohexanedioate #
NSC134297
SBB008252
NSC120723
2,5-Dibromoadipic acid dimethyl ester
1,6-dimethyl 2,5-dibromohexanedioate
A

MDL Number

MFCD00043758

FAQ

What is Dimethyl 2,5-dibromohexanedioate (CAS: 868-72-4)?

Dimethyl 2,5-dibromohexanedioate (CAS 868-72-4) is a chemical compound characterized by its dibrominated hexanedioate ester structure. It is used in various industrial applications and is also of interest in research due to its unique chemical properties.

What are the main uses of Dimethyl 2,5-dibromohexanedioate (CAS: 868-72-4)?

Dimethyl 2,5-dibromohexanedioate (CAS 868-72-4) is primarily used in the synthesis of other organic compounds, as a reagent in chemical reactions, and in certain industrial applications such as polymer synthesis and drug discovery.

Is Dimethyl 2,5-dibromohexanedioate (CAS: 868-72-4) safe?

Dimethyl 2,5-dibromohexanedioate (CAS 868-72-4) is generally safe when handled with appropriate precautions. However, it is important to follow safety guidelines, wear protective equipment, and store it in a secure, dry, and well-ventilated area to minimize risks.

How should Dimethyl 2,5-dibromohexanedioate (CAS: 868-72-4) be stored?

Dimethyl 2,5-dibromohexanedioate (CAS 868-72-4) should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent exposure to moisture and other contaminants. Proper ventilation is also essential to ensure a safe storage environment.