5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone

Basic Information

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CAS Number

118129-60-5

Molecular Formula

C24H6Br2O6

Molecular Weight

550.11 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 Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

Melting Point

360°C

Boiling Point

840.2℃/760mmHg

SMILES

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C1=CC2=C3C(=CC(=C4C3=C1C5=C(C=C6C7=C(C=CC4=C57)C(=O)OC6=O)Br)Br)C(=O)OC2=O

InChI

InChI=1S/C24H6Br2O6/c25-13-5-12-16-10(22(28)32-24(12)30)4-2-8-18-14(26)6-11-15-9(21(27)31-23(11)29)3-1-7(19(15)18)17(13)20(8)16/h1-6H

InChIKey

WPBVUAVIGWNDGT-UHFFFAOYSA-N

LogP

5.8834000000000035

Topological Polar Surface Area

86.74000000000001 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

862

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Synonyms & References

English

5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone
1,7-Dibromo-3,4,9,10-perylenetetracarboxylic Dianhydride
5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']-diisochromene-1,3,8,10-tetraone
1,7-dibromo-3,4:9,10-perylenetetracarboxylic acid dianhydride
1,7-dibromoperylene-3,4,9,10-tetracarboxylic acid 3,4:9,10-dianhydride
1,7-dibromoperylene-3,4,9,10-tetracarboxylic acid dianhydride
1,7-dibromoperylene-3,4:9,10-tetracarboxylic acid bisanhydride
dibromoperylene-3,4,9,10-bis(dicarboxylic anhydride)
1,7-Dibromo-3,4,9,10-Tetracarboxylic Acid Dianhydride
Perylo[3,4-cd:9,10-c,d]dipyran-1,3,8,10-tetrone, 5,12-dibromo-
AK101251
C24H6Br2O6
2958AA
AX8232790
D3871
5,1
CS-0110457
AMY28730
1,7-Dibromo-3,4,9,10-tetracarboxylic acid dianhydride
F11307
118129-60-5
YSSJ01230
GS-5769
11,22-DIBROMO-7,18-DIOXAHEPTACYCLO[14.6.2.2(2),?.0(3),(1)(2).0?,?.0(1)(3),(2)(3).0(2)?,(2)?]HEXACOSA-1(22),2,4,9,11,13(23),14,16(24),20,25-DECAENE-6,8,17,19-TETRONE
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone,5,12-dibromo-
Perylo[3,4-cd:9,10-c'd']dipyran-1,3,8,10-tetrone, 5,12-dibromo-
MFCD11870875
SCHEMBL4324585
AKOS016003164
11,22-dibromo-7,18-dioxaheptacyclo[14.6.2.2^{2,5}.0^{3,12}.0^{4,9}.0^{13,23}.0^{20,24}]hexacosa-1(22),2(26),3,5(25),9,11,13,15,20,23-decaene-6,8,17,19-tetrone
DTXSID00455258

MDL Number

MFCD11870875

FAQ

What are the physical and chemical properties of 5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone (CAS: 118129-60-5)?

5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone is a crystalline compound with a molecular weight of approximately 646.09 g/mol. It has a low water solubility, typically less than 1 mg/L, and exhibits moderate reactivity towards reducing agents and light. This compound is typically stable under normal storage conditions but may photodegrade over time.

How is 5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone (CAS: 118129-60-5) typically synthesized?

5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone is synthesized via a multi-step process involving bromination of anthraquinone followed by specific condensation reactions. Commonly, this involves the use of bromine and a suitable solvent with catalysts such as potassium bromide. The synthesis typically yields 80-85% of the target compound.

What industries use 5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone (CAS: 118129-60-5)?

5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone is primarily used in the pharmaceutical industry for the development of fluorescent probes and sensors. It is also explored in material science for its unique optical properties, making it relevant in the production of certain polymers and semiconductors.

What precautions should be taken when handling 5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone (CAS: 118129-60-5)?

When handling 5,12-Dibromoanthra[2,1,9-def:6,5,10-d'e'f']diisochromene-1,3,8,10-tetraone, appropriate personal protective equipment (PPE) such as gloves, goggles, and protective clothing should be worn. This compound should be handled in a well-ventilated environment or a fume hood to minimize exposure. Spills should be cleaned up with caution, using appropriate chemical spill kits, and the area should be thoroughly washed. Always consult the Material Safety Data Sheet (MSDS/SDS) for specific handling instructions.