1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid

Basic Information

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CAS Number

115-28-6

Molecular Formula

C9H4Cl6O4

Molecular Weight

388.85 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Physical Properties

Melting Point

239-242 °C

Boiling Point

175°C (rough estimate)

Flash Point

239.1 °C

Refractive Index

1.658

SMILES

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C1(C(C2(C(=C(C1(C2(Cl)Cl)Cl)Cl)Cl)Cl)C(=O)O)C(=O)O

InChI

InChI=1S/C9H4Cl6O4/c10-3-4(11)8(13)2(6(18)19)1(5(16)17)7(3,12)9(8,14)15/h1-2H,(H,16,17)(H,18,19)

InChIKey

DJKGDNKYTKCJKD-UHFFFAOYSA-N

LogP

3.2335000000000003

Topological Polar Surface Area

74.6 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

487

Safety Information

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GHS Hazard Pictograms

H318

H351

Hazard Statement

H318 Causes serious eye damage
Serious eye damage/eye irritation

H351 Suspected of causing cancer
Carcinogenicity

Stability

Stable. Incompatible with strong oxidizing agents.

Synonyms & References

English

NSC-22225
Kyselina 3,6-endomethylen-3,4,5,6,7,7-hexachlor-.delta.(4)-tetrahyroftalova
1,4,5,6,7,7-Hexachloro-8,9,10-trinorborn-5-ene-2,3-dicarboxylic acid
Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
DTXCID80268
DTXSID2020268
EN300-24974
CHEBI:76603
Kyselina het [Czech]
1,4,5,6,7,7-hexachlorobicyclo-(2,2,1)-hept-5-ene-2,3-dicarboxylic acid
7374-78-9
SCHEMBL159505
1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid
HET acid
WLN: L55 A CUTJ AG AG BG CG DG EG FVQ GVQ
SMR001224506
NSC 22231
NCGC00253973-01
NCGC00259888-01
CHLORENDIC ACID
Hexachloroendomethylenetetrahydrophthalic acid
FT-0626941
NS00004196
HMS3039F04
Bicyclo[2.2.1]-5-heptene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-
MLS002152895
Kyselina 1,2,3,4,7,7-hexachlorbicyklo(2,2,1)hept-2-en-5,6-dikarboxylova
D90788
NSC41876
DJKGDNKYTKCJKD-UHFFFAOYSA-N
BDBM94954

MDL Number

MFCD00167589

Customs Code

2917209090

FAQ

What is 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (CAS: 115-28-6)?

1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (CAS: 115-28-6) is a synthetic organic compound characterized by its hexachlorinated structure and dicarboxylic acid functionality. It is highly stable and has a high melting point.

What are the main uses of 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (CAS: 115-28-6)?

This compound is primarily used in the synthesis of other chlorinated compounds and as a precursor in organic chemistry. It is also utilized in the production of dyes and pharmaceuticals due to its unique chemical properties.

Is 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (CAS: 115-28-6) safe?

The compound is generally considered safe for laboratory use under controlled conditions. However, it is highly chlorinated and thus requires proper handling to avoid inhalation or skin contact. Protective equipment such as gloves and a respirator should be used.

How should 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid (CAS: 115-28-6) be stored?

1,4,5,6,7,7-Hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent exposure to light and air. Storage temperature should not exceed 25°C.