Aluminium tris(4-oxo-2-penten-2-olate)

Basic Information

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CAS Number

13963-57-0

Molecular Formula

C15H21AlO6

Molecular Weight

324.31 g/mol

EINECS

237-741-6

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Melting Point

190-193 °C

Boiling Point

315 °C

Density

1,27 g/cm3

Water Solubility

2.5 g/L (20 ºC)

Flash Point

314-316°C

Vapor Pressure

0Pa at 25℃

SMILES

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CC(=CC(=O)C)O[Al](OC(=CC(=O)C)C)OC(=CC(=O)C)C

InChI

InChI=1S/3C5H8O2.Al/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3

InChIKey

KILURZWTCGSYRE-UHFFFAOYSA-K

LogP

2.4995000000000003

Topological Polar Surface Area

78.9 Å²

Hydrogen Bond Donor/Acceptor

0 / 6

Complexity

380

Safety Information

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GHS Hazard Pictograms

H300

H315

H319

H335

Hazard Statement

H300 Fatal if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Hazard Class

Class 6.1 Class 6.1

Stability

Stable. Incompatible with strong oxidizers.

Hydrolysis Sensitivity

4: no reaction with water under neutral conditions

Sensitiveness

Sensitive to humidity

Auto-ignition Temperature

500 °C

Toxicity

LD50 orally in Rabbit: 48.7 mg/kg

Synonyms & References

English

aluminumtris(acetylacetonate)
tris(2,4-pentanedionato)-aluminu
Tris(2,4-pentanedionato)aluminum
tris(2,4-pentanedionato-O,O’)-,(OC-6-11)-Aluminum
tris(2,4-pentanedione)aluminum
tris(acetylacetonate)aluminum(iii
Tris(acetylacetonato) aluminium(III)
Tris(acetylacetonato)aluminum
Aluminum acetylacetonate
Aluminum 2,4-pentanedionate
tris(pentane-2,4-dionato-O,O)aluminium
Aluminium acetylacetonate
Acetyl Acetonate
Aluminium 2,4-pentanedionate
Tris(acetylacetonato)aluminium(III)
Tris(2,4-pentanedionato)aluminium(III)
Aluminum triacetylacetone
Tris(2,4-pentanedionato)aluminum(III)
ALUMINUM(III) 2,4-PENTANEDIONATE
ACETYLACETONE ALUMINIUM
Acetylacetone Aluminum(III) Salt
AL(ACAC)3
Al(acac)3,Aluminum 2,4-pentanedionate
alumi
Alumin
Aluminum acetoacetonate
Aluminum Chelate A
ALUMINUM(III) AA
aluminum(III) trisacetylacetonate
Dotite Al
Nacem Aluminum

MDL Number

MFCD00000013

EC Number

237-741-6

Customs Code

29420000

FAQ

What is Aluminium tris(4-oxo-2-penten-2-olate) (CAS: 13963-57-0)?

Aluminium tris(4-oxo-2-penten-2-olate) is a coordination compound with the CAS number 13963-57-0. It consists of an aluminium ion bonded to three 4-oxo-2-penten-2-olate ligands, which are derived from 4-oxo-2-pentenoic acid. This compound is typically used as a reagent in organic synthesis and exhibits solubility in polar solvents. Its chemical structure and properties make it valuable in various chemical applications.

What are the main uses of Aluminium tris(4-oxo-2-penten-2-olate) (CAS: 13963-57-0)?

Aluminium tris(4-oxo-2-penten-2-olate) (CAS: 13963-57-0) is primarily used in pharmaceutical research as a catalyst or intermediate in drug synthesis. It also finds applications in industrial processes involving organic reactions and polymer production. In laboratory settings, it serves as a key component in chemical reactions requiring aluminium-based coordination complexes. Its versatility supports research and development across multiple fields.

Is Aluminium tris(4-oxo-2-penten-2-olate) (CAS: 13963-57-0) safe?

Aluminium tris(4-oxo-2-penten-2-olate) is generally considered safe when handled properly. However, it may cause mild irritation if inhaled or in contact with skin/eyes. Safety precautions include wearing protective gloves, goggles, and lab coats. Adherence to OSHA and EPA guidelines is recommended to ensure safe usage. Always follow established protocols for chemical handling and disposal.

How should Aluminium tris(4-oxo-2-penten-2-olate) (CAS: 13963-57-0) be stored?

Aluminium tris(4-oxo-2-penten-2-olate) should be stored in a cool, dry place, away from light and moisture. Keep in a sealed, airtight container to maintain stability and prevent degradation. Avoid exposure to air or humidity to ensure long-term storage. Store in a well-ventilated area and follow manufacturer guidelines for optimal preservation.