Identification	Physical Data	Spectra
Route of Synthesis (ROS)	Safety and Hazards	Other Data

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Identification

英文名	GalliuM Maltolate
IUPAC Name	gallium;2-methyl-4-oxopyran-3-olate
分子结构
CAS编号	108560-70-9
EINECS Number	No data available
MDL Number	No data available
Beilstein Registry Number	No data available
别名	gallium maltolatetris(maltolato)gallium(III)gallium (III) maltolate
分子式	C18H15GaO9
分子量	445.029
InChI	InChI=1S/3C6H6O3.Ga/c31-4-6(8)5(7)2-3-9-4;/h32-3,8H,1H3;/q;;;+3/p-3
InChI Key	ASYYOZSDALANRF-UHFFFAOYSA-K
Canonical SMILES	Cc1c(c(=O)cco1)[O-].Cc1c(c(=O)cco1)[O-].Cc1c(c(=O)cco1)[O-].[Ga+3]

Patent Information

No data available

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Physical Data

Appearance	Off-white or light pink powder
Solubility	No data available
Flash Point	No data available
Refractive index	No data available
Sensitivity	No data available

Melting Point, °C	Comment (Melting Point)
220	with decomposition

Comment (Solubility (MCS))

soluble in methanol, ethanol

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Spectra

Nucleus (NMR Spectroscopy)	Coupling Nuclei	Solvents (NMR Spectroscopy)	Comment (NMR Spectroscopy)
1H	1H	D2O	Signals given

Description (IR Spectroscopy)	Solvent (IR Spectroscopy)	Comment (IR Spectroscopy)
Bands	KBr	200 cm**-1 – 3070 cm**-1

Comment (Mass Spectrometry)

Molecular peak, Fragmentation pattern

Solvent (UV/VIS Spectroscopy)	Comment (UV/VIS Spectroscopy)
further solvent(s)	250 nm – 305 nm

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Route of Synthesis (ROS)

Conditions	Yield
In water with const. stirring maltol and GaCl3 was added to water, pH was adjused to 8.3, mixt. was heated to 65°C; soln. was filtered, washed with acetone, dried in vac., recrystd. from methanol/ether; elem.anal.;	90%

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Safety and Hazards

GHS Hazard Statements	Not Classified
	For more detailed information, please visit ECHA C&L website

Source: European Chemicals Agency (ECHA) License Note: Use of the information, documents and data from the ECHA website is subject to the terms and conditions of this Legal Notice, and subject to other binding limitations provided for under applicable law, the information, documents and data made available on the ECHA website may be reproduced, distributed and/or used, totally or in part, for non-commercial purposes provided that ECHA is acknowledged as the source: “Source: European Chemicals Agency, http://echa.europa.eu/”. Such acknowledgement must be included in each copy of the material. ECHA permits and encourages organisations and individuals to create links to the ECHA website under the following cumulative conditions: Links can only be made to webpages that provide a link to the Legal Notice page. License URL: https://echa.europa.eu/web/guest/legal-notice Record Name: (1-Cyano-2-ethoxy-2-oxoethylidenaminooxy)dimethylamino-morpholino-carbenium hexafluorophosphate URL: https://echa.europa.eu/information-on-chemicals/cl-inventory-database/-/discli/details/213446 Description: The information provided here is aggregated from the “Notified classification and labelling” from ECHA’s C&L Inventory. Read more: https://echa.europa.eu/information-on-chemicals/cl-inventory-database

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Other Data

Transportation	Under the room temperature and away from light
HS Code	No data available
Storage	Under the room temperature and away from light
Shelf Life	2 years
Market Price	USD

Druglikeness
Lipinski rules component
分子量	445.035
HBA	9
HBD	0
Matching Lipinski Rules	3
Veber rules component
Polar Surface Area (PSA)	55.38
Rotatable Bond (RotB)	0
Matching Veber Rules	2

Use Pattern

inhibiting bacterial growth, killing the bacteria, and/or by facilitating the destruction of the biofilm

bacterial keratitis

inhibiting the growth of lymphoma cells resistant to gallium nitrate GaN; induced cell apoptosis

gallium-nitrate (GaN) resistant lymphoma

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