Tris(pentane-2,4-dionato-O,O')scandium supplier

Name
SCANDIUM (III) 2,4-PENTANEDIONATE
EINECS 238-194-6
CAS No. 14284-94-7
Article Data9
CAS DataBase
Density
Solubility
Melting Point 174-186 °C (lit.)
Formula C₁₅H₂₁O₆Sc
Boiling Point 187.6 °C at 760 mmHg
Molecular Weight 342.284
Flash Point 71.9 °C
Transport Information
Appearance
Safety 22-26-36
Risk Codes 22-36/37/38
Molecular Structure
Hazard Symbols Xn
Synonyms Scandium,tris(2,4-pentanedionato)- (6CI,7CI,8CI);Scandium,tris(2,4-pentanedionato-O,O')-, (OC-6-11)-;Scandium, tris(2,4-pentanedionato-kO,kO')-, (OC-6-11)- (9CI);Scandiumtris(acetylacetonate);Tris(acetylacetonato)scandium;
PSA 78.90000
LogP 2.88030

Tris(pentane-2,4-dionato-O,O')scandium Specification

The Tris(pentane-2, 4-dionato-O, O')scandium, with the CAS registry number 14284-94-7, is also known as Scandium tris(4-oxopent-2-en-2-olate). Its EINECS registry number is 238-194-6. This chemical's molecular formula is C₁₅H₂₁O₆Sc and molecular weight is 342.28. What's more, its IUPAC name is 4-Oxopent-2-en-2-olate; scandium(3+).

Physical properties about Tris(pentane-2, 4-dionato-O, O')scandium are: (1)ACD/LogP: 0.29; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.29; (4)ACD/LogD (pH 7.4): 0.25; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 34.16; (8)ACD/KOC (pH 7.4): 31.16; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.3 Å²; (13)Flash Point: 71.9 °C; (14)Enthalpy of Vaporization: 49.32 kJ/mol; (15)Boiling Point: 187.6 °C at 760 mmHg; (16)Vapour Pressure: 0.174 mmHg at 25 °C.

When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. In addition, this chemical is harmful if swallowed. Besides, the dust of this chemical can not be breathed. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: [Sc+3].O=C(C=C([O-])C)C.[O-]C(=CC(=O)C)C.[O-]C(=CC(=O)C)C
(2) InChI: InChI=1/3C5H8O2.Sc/c3*1-4(6)3-5(2)7;/h3*3,6H,1-2H3;/q;;;+3/p-3
(3) InChIKey: QEXWAFFWPWSBON-DFZHHIFOAT

Product Name

SCANDIUM (III) 2,4-PENTANEDIONATE

Tris(pentane-2,4-dionato-O,O')scandium Specification

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