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Basic Information
CAS No.: 17524-05-9
Name: Molybdenyl acetylacetonate
Molecular Structure:
Molecular Structure of 17524-05-9 (Molybdenyl acetylacetonate)
Formula: C10H14MoO6
Molecular Weight: 326.15
Synonyms: Molybdenum,dioxobis(2,4-pentanedionato)- (6CI,7CI,8CI);Molybdenum,dioxobis(2,4-pentanedionato-O,O')-, (OC-6-21)-;Molybdenum,dioxobis(2,4-pentanedionato-kO,kO')-, (OC-6-21)- (9CI);Bis(2,4-pentanedionato)dioxomolybdenum;Bis(acetoacetonato)dioxomolybdenum;Bis(acetylacetonate)dioxomolybdenum;Bis(acetylacetonato)dioxomolybdenum;Bis(acetylacetonato)dioxomolybdenum(VI);Bis(acetylacetonato)molybdenumdioxide;Dioxobis(2,4-pentanedionato)molybdenum;Dioxobis(2,4-pentanedionato)molybdenum(VI);Dioxobis(2,4-pentanedionato-O,O')molybdenum;Dioxomolybdenumbis(acetylacetonate);Dioxomolybdenum(VI) acetylacetonate;Dioxomolybdenum(VI)bis(acetylacetonate);Molybdenum diacetylacetonate dioxide;Molybdenum dioxidebis(acetylacetonate);Molybdenum dioxydiacetylacetonate;Molybdenylacetylacetonate;NSC 52176;cis-Bis(acetylacetonato)dioxomolybdenum;cis-Dioxobis(2,4-pentanedionato)molybdenum;
EINECS: 241-522-0
Density: 1,64 g/cm3
Melting Point: 184 °C (dec.)(lit.)
Boiling Point: 138.4oC at 760mmHg
Flash Point: 43.1oC
Solubility: 8.52 g/100 mL (20 ºC)
Appearance: light yellow, greyish green to yellow-brown
Hazard Symbols: IrritantXi; HarmfulXn
Risk Codes: 20/21/22-36/37/38-40
Safety: 23-26-36/37/39-45-24/25
PSA: 86.74000
LogP: 1.68260
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Specification

The Molybdenyl acetylacetonate, with CAS registry number 17524-05-9, belongs to the following product categories: (1)Mo (Molybdenum) Compounds; (2)Catalysts for Organic Synthesis; (3)Classes of Metal Compounds; (4)Homogeneous Catalysts; (5)Metal Complexes; (6)Synthetic Organic Chemistry; (7)Transition Metal Compounds; (8)Catalysis and Inorganic Chemistry; (9)Chemical Synthesis; (10)Molybdenum. It has the systematic name of oxomolybdenum; (Z)-4-oxopent-2-en-2-olate. This chemical is a kind of light yellow, greyish green to yellow-brown. And the chemical formula of this chemical is C10H14MoO6. What's more, its EINECS is 241-522-0.

Physical properties of Molybdenyl acetylacetonate: (1)#H bond acceptors: 5; (2)#H bond donors: 2; (3)#Freely Rotating Bonds: 4; (4)Polar Surface Area: 97.33 Å2.

When you are using this chemical, please be cautious about it as the following:
The Molybdenyl acetylacetonate irritates to eyes, respiratory system and skin. And it is harmful by inhalation, in contact with skin and if swallowed. It also has limited evidence of a carcinogenic effect. You should avoid contact with skin and eyes. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(C)\C=C(/[O-])C.[O-]\C(C)=C/C(C)=O.[Mo+2]=O
(2)InChI: InChI=1/2C5H8O2.Mo.O/c2*1-4(6)3-5(2)7;;/h2*3,6H,1-2H3;;/q;;+2;/p-2/b2*4-3-;;/r2C5H8O2.MoO/c2*1-4(6)3-5(2)7;1-2/h2*3,6H,1-2H3;/q;;+2/p-2/b2*4-3-
(3)InChIKey: GDODZIQDXZBRQL-RSKGWCSGBY
(4)Std. InChI: InChI=1S/2C5H8O2.Mo.O/c2*1-4(6)3-5(2)7;;/h2*3,6H,1-2H3;;/q;;+2;/p-2/b2*4-3-
(5)Std. InChIKey: GDODZIQDXZBRQL-SUKNRPLKSA-L